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Azoles

Organic compounds that consist of five-membered heterocyclic molecules containing a nitrogen atom and at least one other non-carbon atom as part of the ring.
Thiazoles (217)
Imidazoles (136)
Pyrazoles (98)
Isoxazoles (93)
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1 – 15 of 318 results
1

2-Methyl-1,3-thiazole-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 35272-15-2 Molecular Formula: C5H5NO2S Molecular Weight (g/mol): 143.16 MDL Number: MFCD03407332 InChI Key: ZHDRDZMTEOIWSX-UHFFFAOYSA-N Synonym: 2-methylthiazole-4-carboxylic acid,2-methyl-4-thiazolecarboxylic acid,4-thiazolecarboxylic acid, 2-methyl,2-methyl-thiazole-4-carboxylic acid,2-methyl-4-thiazolecarboxylicacid,2-methyl-thiazole4-carboxylic acid,4-thiazolecarboxylicacid, 2-methyl,2-methyl-1,3-thiazole-4-carboxylicacid PubChem CID: 284728 IUPAC Name: 2-methyl-1,3-thiazole-4-carboxylic acid SMILES: CC1=NC(=CS1)C(=O)O

PubChem CID 284728
CAS 35272-15-2
Molecular Weight (g/mol) 143.16
MDL Number MFCD03407332
SMILES CC1=NC(=CS1)C(=O)O
Synonym 2-methylthiazole-4-carboxylic acid,2-methyl-4-thiazolecarboxylic acid,4-thiazolecarboxylic acid, 2-methyl,2-methyl-thiazole-4-carboxylic acid,2-methyl-4-thiazolecarboxylicacid,2-methyl-thiazole4-carboxylic acid,4-thiazolecarboxylicacid, 2-methyl,2-methyl-1,3-thiazole-4-carboxylicacid
IUPAC Name 2-methyl-1,3-thiazole-4-carboxylic acid
InChI Key ZHDRDZMTEOIWSX-UHFFFAOYSA-N
Molecular Formula C5H5NO2S
2

Isoxazole-5-carboxylic acid, 95%, Thermo Scientific™

CAS: 21169-71-1 Molecular Formula: C4H3NO3 Molecular Weight (g/mol): 113.072 MDL Number: MFCD00156151 InChI Key: MIIQJAUWHSUTIT-UHFFFAOYSA-N Synonym: isoxazole-5-carboxylic acid,5-isoxazolecarboxylic acid,isoxazole-5-carboxylicacid,5-carboxyisoxazole,pubchem8643,isoxazole-5-carboxylic,5-carboxy-1,2-oxazole,isoxazole 5-carboxylic acid,ksc207s2h PubChem CID: 2060599 IUPAC Name: 1,2-oxazole-5-carboxylic acid SMILES: C1=C(ON=C1)C(=O)O

PubChem CID 2060599
CAS 21169-71-1
Molecular Weight (g/mol) 113.072
MDL Number MFCD00156151
SMILES C1=C(ON=C1)C(=O)O
Synonym isoxazole-5-carboxylic acid,5-isoxazolecarboxylic acid,isoxazole-5-carboxylicacid,5-carboxyisoxazole,pubchem8643,isoxazole-5-carboxylic,5-carboxy-1,2-oxazole,isoxazole 5-carboxylic acid,ksc207s2h
IUPAC Name 1,2-oxazole-5-carboxylic acid
InChI Key MIIQJAUWHSUTIT-UHFFFAOYSA-N
Molecular Formula C4H3NO3
3

1-Methyl-1H-imidazole-4-sulfonamide, 97%, Thermo Scientific™

CAS: 111124-90-4 Molecular Formula: C4H7N3O2S Molecular Weight (g/mol): 161.18 MDL Number: MFCD02091382 InChI Key: QBJSSOBNVYDCDQ-UHFFFAOYSA-N PubChem CID: 2736885 IUPAC Name: 1-methylimidazole-4-sulfonamide SMILES: CN1C=NC(=C1)S(N)(=O)=O

PubChem CID 2736885
CAS 111124-90-4
Molecular Weight (g/mol) 161.18
MDL Number MFCD02091382
SMILES CN1C=NC(=C1)S(N)(=O)=O
IUPAC Name 1-methylimidazole-4-sulfonamide
InChI Key QBJSSOBNVYDCDQ-UHFFFAOYSA-N
Molecular Formula C4H7N3O2S
4

3-(tert-Butyl)-1-methyl-1H-pyrazol-5-amine, 97%, Thermo Scientific™

CAS: 118430-73-2 Molecular Formula: C8H15N3 Molecular Weight (g/mol): 153.23 MDL Number: MFCD00068002 InChI Key: XSCDSAMVQLKDNI-UHFFFAOYSA-N Synonym: 5-amino-3-tert-butyl-1-methylpyrazole,3-tert-butyl-1-methyl-1h-pyrazol-5-amine,5-tert-butyl-2-methyl-2h-pyrazol-3-ylamine,1h-pyrazol-5-amine, 3-1,1-dimethylethyl-1-methyl,5-amino-3-tert-butyl-1-methyl-1h-pyrazole,3-tert-butyl-1-methylpyrazole-5-ylamine,acmc-1cins,maybridge4_002215,5-amino-1-methyl-3-tert-butylpyrazole PubChem CID: 2735287 SMILES: CN1N=C(C=C1N)C(C)(C)C

PubChem CID 2735287
CAS 118430-73-2
Molecular Weight (g/mol) 153.23
MDL Number MFCD00068002
SMILES CN1N=C(C=C1N)C(C)(C)C
Synonym 5-amino-3-tert-butyl-1-methylpyrazole,3-tert-butyl-1-methyl-1h-pyrazol-5-amine,5-tert-butyl-2-methyl-2h-pyrazol-3-ylamine,1h-pyrazol-5-amine, 3-1,1-dimethylethyl-1-methyl,5-amino-3-tert-butyl-1-methyl-1h-pyrazole,3-tert-butyl-1-methylpyrazole-5-ylamine,acmc-1cins,maybridge4_002215,5-amino-1-methyl-3-tert-butylpyrazole
InChI Key XSCDSAMVQLKDNI-UHFFFAOYSA-N
Molecular Formula C8H15N3
5

2-Methyl-1,3-thiazole-4-carboximidamide hydrochloride, 97%, Thermo Scientific™

CAS: 18876-82-9 Molecular Formula: C5H8ClN3S Molecular Weight (g/mol): 177.65 MDL Number: MFCD00178765 InChI Key: YYLYRAUCGUIGIE-UHFFFAOYSA-N Synonym: 2-methyl-1,3-thiazole-4-carboximidamide hydrochloride,2-methylthiazole-4-carboxamidine hydrochloride,2-methyl-thiazole-4-carboxamidine hydrochloride,2-methylthiazole-4-carboximidamide hydrochloride,2-methyl-1,3-thiazole-4-carboxamidine, chloride,4-thiazolecarboximidamide,2-methyl-,hydrochloride 1:1 PubChem CID: 2799402 IUPAC Name: 2-methyl-1,3-thiazole-4-carboximidamide;hydrochloride SMILES: CC1=NC(=CS1)C(=N)N.Cl

PubChem CID 2799402
CAS 18876-82-9
Molecular Weight (g/mol) 177.65
MDL Number MFCD00178765
SMILES CC1=NC(=CS1)C(=N)N.Cl
Synonym 2-methyl-1,3-thiazole-4-carboximidamide hydrochloride,2-methylthiazole-4-carboxamidine hydrochloride,2-methyl-thiazole-4-carboxamidine hydrochloride,2-methylthiazole-4-carboximidamide hydrochloride,2-methyl-1,3-thiazole-4-carboxamidine, chloride,4-thiazolecarboximidamide,2-methyl-,hydrochloride 1:1
IUPAC Name 2-methyl-1,3-thiazole-4-carboximidamide;hydrochloride
InChI Key YYLYRAUCGUIGIE-UHFFFAOYSA-N
Molecular Formula C5H8ClN3S
7

2-Methyl-1,3-thiazole-4-carbaldehyde, 97%, Thermo Scientific™

CAS: 20949-84-2 Molecular Formula: C5H5NOS Molecular Weight (g/mol): 127.16 MDL Number: MFCD06655197 InChI Key: AEHWVNPVEUVPMT-UHFFFAOYSA-N PubChem CID: 2763191 IUPAC Name: 2-methyl-1,3-thiazole-4-carbaldehyde SMILES: CC1=NC(C=O)=CS1

PubChem CID 2763191
CAS 20949-84-2
Molecular Weight (g/mol) 127.16
MDL Number MFCD06655197
SMILES CC1=NC(C=O)=CS1
IUPAC Name 2-methyl-1,3-thiazole-4-carbaldehyde
InChI Key AEHWVNPVEUVPMT-UHFFFAOYSA-N
Molecular Formula C5H5NOS
8

2-(2,3-Dihydro-1-benzofuran-5-yl)-4-methyl-1,3-thiazole-5-carboxylic acid, 97%, Thermo Scientific™

CAS: 690632-04-3 Molecular Formula: C13H11NO3S Molecular Weight (g/mol): 261.295 MDL Number: MFCD01313483 InChI Key: DCXMMNGTUXDRND-UHFFFAOYSA-N Synonym: 2-2,3-dihydro-1-benzofuran-5-yl-4-methyl-1,3-thiazole-5-carboxylic acid,2-2,3-dihydrobenzofuran-5-yl-4-methylthiazole-5-carboxylic acid,2-2,3-dihydro-1-benzo b furan-5-yl-4-methyl-1,3-thiazole-5-carboxylic acid,2-2,3-dihydrobenzo b furan-5-yl-4-methyl-1,3-thiazole-5-carboxylic acid PubChem CID: 2798545 IUPAC Name: 2-(2,3-dihydro-1-benzofuran-5-yl)-4-methyl-1,3-thiazole-5-carboxylic acid SMILES: CC1=C(SC(=N1)C2=CC3=C(C=C2)OCC3)C(=O)O

PubChem CID 2798545
CAS 690632-04-3
Molecular Weight (g/mol) 261.295
MDL Number MFCD01313483
SMILES CC1=C(SC(=N1)C2=CC3=C(C=C2)OCC3)C(=O)O
Synonym 2-2,3-dihydro-1-benzofuran-5-yl-4-methyl-1,3-thiazole-5-carboxylic acid,2-2,3-dihydrobenzofuran-5-yl-4-methylthiazole-5-carboxylic acid,2-2,3-dihydro-1-benzo b furan-5-yl-4-methyl-1,3-thiazole-5-carboxylic acid,2-2,3-dihydrobenzo b furan-5-yl-4-methyl-1,3-thiazole-5-carboxylic acid
IUPAC Name 2-(2,3-dihydro-1-benzofuran-5-yl)-4-methyl-1,3-thiazole-5-carboxylic acid
InChI Key DCXMMNGTUXDRND-UHFFFAOYSA-N
Molecular Formula C13H11NO3S
10

3-(Chloromethyl)-5-methylisoxazole, 97%, Thermo Scientific™

CAS: 35166-37-1 Molecular Formula: C5H6ClNO Molecular Weight (g/mol): 131.56 MDL Number: MFCD00221166 InChI Key: FEXTXBAFBURKGS-UHFFFAOYSA-N Synonym: 3-chloromethyl-5-methylisoxazole,3-chloromethyl-5-methyl-1,2-oxazole,3-chloromethyl-5-methyl-isoxazole,pubchem8710,zlchem 1024,acmc-209idp,3-chloromethyl-5-methyisoxazole,3-choromethyl-5-methylisoxazole,5-methyl-3-chloromethylisoxazole PubChem CID: 2735763 IUPAC Name: 3-(chloromethyl)-5-methyl-1,2-oxazole SMILES: CC1=CC(CCl)=NO1

PubChem CID 2735763
CAS 35166-37-1
Molecular Weight (g/mol) 131.56
MDL Number MFCD00221166
SMILES CC1=CC(CCl)=NO1
Synonym 3-chloromethyl-5-methylisoxazole,3-chloromethyl-5-methyl-1,2-oxazole,3-chloromethyl-5-methyl-isoxazole,pubchem8710,zlchem 1024,acmc-209idp,3-chloromethyl-5-methyisoxazole,3-choromethyl-5-methylisoxazole,5-methyl-3-chloromethylisoxazole
IUPAC Name 3-(chloromethyl)-5-methyl-1,2-oxazole
InChI Key FEXTXBAFBURKGS-UHFFFAOYSA-N
Molecular Formula C5H6ClNO
11

(1-Methyl-1H-indazol-3-yl)methylamine dihydrochloride, 97%, Thermo Scientific™

CAS: 1093860-45-7 Molecular Formula: C9H13Cl2N3 Molecular Weight (g/mol): 234.124 MDL Number: MFCD11841065 InChI Key: ZHWICCCSNYFLJY-UHFFFAOYSA-N Synonym: 1-methyl-1h-indazol-3-yl methylamine dihydrochloride,1-methylindazol-3-yl methanamine dihydrochloride,1-methyl-1h-indazol-3-yl methanamine dihydrochloride,3-aminomethyl-1-methyl-1h-indazole dihydrochloride,1-methyl-1h-indazol-3-yl methylamine 2hcl,1-methyl-1h-indazol-3-yl methylamine, chloride, chloride,1-1-methylindazol-3-yl methanamine dihydrochloride,1-1-methyl-1h-indazol-3-yl methanamine-hydrogen chloride 1/2 PubChem CID: 43811028 IUPAC Name: (1-methylindazol-3-yl)methanamine;dihydrochloride SMILES: CN1C2=CC=CC=C2C(=N1)CN.Cl.Cl

PubChem CID 43811028
CAS 1093860-45-7
Molecular Weight (g/mol) 234.124
MDL Number MFCD11841065
SMILES CN1C2=CC=CC=C2C(=N1)CN.Cl.Cl
Synonym 1-methyl-1h-indazol-3-yl methylamine dihydrochloride,1-methylindazol-3-yl methanamine dihydrochloride,1-methyl-1h-indazol-3-yl methanamine dihydrochloride,3-aminomethyl-1-methyl-1h-indazole dihydrochloride,1-methyl-1h-indazol-3-yl methylamine 2hcl,1-methyl-1h-indazol-3-yl methylamine, chloride, chloride,1-1-methylindazol-3-yl methanamine dihydrochloride,1-1-methyl-1h-indazol-3-yl methanamine-hydrogen chloride 1/2
IUPAC Name (1-methylindazol-3-yl)methanamine;dihydrochloride
InChI Key ZHWICCCSNYFLJY-UHFFFAOYSA-N
Molecular Formula C9H13Cl2N3
12

1-Methyl-1H-imidazole-5-carbohydrazide, 97%, Thermo Scientific™

CAS: 23585-00-4 Molecular Formula: C5H8N4O Molecular Weight (g/mol): 140.15 MDL Number: MFCD03659706 InChI Key: CFIAOJVURKEWPG-UHFFFAOYSA-N Synonym: 1-methyl-1h-imidazole-5-carbohydrazide,1-methyl-1h-imidazole-5-carboxylic acid hydrazide,1h-imidazole-5-carboxylicacid, 1-methyl-, hydrazide,1-methyl-5-imidazoliecarboxylic hydrazide,1-methylimidazole-5-carbohydrazide,1-methyl-1h-imidazole-5-carbohydrazide #,5-hydrazinocarbonyl-1-methyl-1h-imidazole,imidazole-1-methyl-5-carboxylic acid, hydrazide,1h-imidazole-5-carboxylicacid,1-methyl-,hydrazide,1h-imidazole-5-carboxylic acid, 1-methyl-, hydrazide 9ci PubChem CID: 468661 IUPAC Name: 3-methylimidazole-4-carbohydrazide SMILES: CN1C=NC=C1C(=O)NN

PubChem CID 468661
CAS 23585-00-4
Molecular Weight (g/mol) 140.15
MDL Number MFCD03659706
SMILES CN1C=NC=C1C(=O)NN
Synonym 1-methyl-1h-imidazole-5-carbohydrazide,1-methyl-1h-imidazole-5-carboxylic acid hydrazide,1h-imidazole-5-carboxylicacid, 1-methyl-, hydrazide,1-methyl-5-imidazoliecarboxylic hydrazide,1-methylimidazole-5-carbohydrazide,1-methyl-1h-imidazole-5-carbohydrazide #,5-hydrazinocarbonyl-1-methyl-1h-imidazole,imidazole-1-methyl-5-carboxylic acid, hydrazide,1h-imidazole-5-carboxylicacid,1-methyl-,hydrazide,1h-imidazole-5-carboxylic acid, 1-methyl-, hydrazide 9ci
IUPAC Name 3-methylimidazole-4-carbohydrazide
InChI Key CFIAOJVURKEWPG-UHFFFAOYSA-N
Molecular Formula C5H8N4O
13

(3-Methylisoxazol-5-yl)methanol, 97%, Thermo Scientific™

CAS: 14716-89-3 Molecular Formula: C5H7NO2 Molecular Weight (g/mol): 113.116 MDL Number: MFCD09859210 InChI Key: OFSDWHRZVRCPBR-UHFFFAOYSA-N Synonym: 3-methylisoxazol-5-yl methanol,3-methyl-1,2-oxazol-5-yl methanol,3-methyl-5-isoxazolemethanol,5-isoxazolemethanol,3-methyl,3-methylisoxazol-5-yl methan-1-ol,3-methylisoxazole-5-methanol,5-isoxazolemethanol, 3-methyl,3-methyl-5-isoxazolyl methanol,5-hydroxymethyl-3-methylisoxazole,5-hydroxymethyl-3-methyl-isoxazole PubChem CID: 10820493 IUPAC Name: (3-methyl-1,2-oxazol-5-yl)methanol SMILES: CC1=NOC(=C1)CO

PubChem CID 10820493
CAS 14716-89-3
Molecular Weight (g/mol) 113.116
MDL Number MFCD09859210
SMILES CC1=NOC(=C1)CO
Synonym 3-methylisoxazol-5-yl methanol,3-methyl-1,2-oxazol-5-yl methanol,3-methyl-5-isoxazolemethanol,5-isoxazolemethanol,3-methyl,3-methylisoxazol-5-yl methan-1-ol,3-methylisoxazole-5-methanol,5-isoxazolemethanol, 3-methyl,3-methyl-5-isoxazolyl methanol,5-hydroxymethyl-3-methylisoxazole,5-hydroxymethyl-3-methyl-isoxazole
IUPAC Name (3-methyl-1,2-oxazol-5-yl)methanol
InChI Key OFSDWHRZVRCPBR-UHFFFAOYSA-N
Molecular Formula C5H7NO2
14

4-Methyl-2-pyrid-3-yl-1,3-thiazole-5-carbaldehyde, 97%, Thermo Scientific™

CAS: 958443-39-5 Molecular Formula: C10H8N2OS Molecular Weight (g/mol): 204.247 MDL Number: MFCD12198119 InChI Key: KHHZRQVJLBGSNM-UHFFFAOYSA-N Synonym: 4-methyl-2-pyridin-3-yl thiazole-5-carbaldehyde,4-methyl-2-pyrid-3-yl-1,3-thiazole-5-carbaldehyde,4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbaldehyde,4-methyl-2-pyridin-3-yl-thiazole-5-carbaldehyde,4-methyl-2-3-pyridyl-1,3-thiazole-5-carbaldehyde PubChem CID: 43811058 IUPAC Name: 4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbaldehyde SMILES: CC1=C(SC(=N1)C2=CN=CC=C2)C=O

PubChem CID 43811058
CAS 958443-39-5
Molecular Weight (g/mol) 204.247
MDL Number MFCD12198119
SMILES CC1=C(SC(=N1)C2=CN=CC=C2)C=O
Synonym 4-methyl-2-pyridin-3-yl thiazole-5-carbaldehyde,4-methyl-2-pyrid-3-yl-1,3-thiazole-5-carbaldehyde,4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbaldehyde,4-methyl-2-pyridin-3-yl-thiazole-5-carbaldehyde,4-methyl-2-3-pyridyl-1,3-thiazole-5-carbaldehyde
IUPAC Name 4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbaldehyde
InChI Key KHHZRQVJLBGSNM-UHFFFAOYSA-N
Molecular Formula C10H8N2OS
15

Methyle2-(2,5-dimethyl-1,3-thiazol-4-yl)acetate, 97%, Thermo Scientific™

CAS: 306937-37-1 Molecular Formula: C8H11NO2S Molecular Weight (g/mol): 185.241 MDL Number: MFCD02677686 InChI Key: AUEJOXGQRQYLDJ-UHFFFAOYSA-N Synonym: methyl 2-2,5-dimethyl-1,3-thiazol-4-yl acetate,methyl 2-2,5-dimethylthiazol-4-yl acetate,methyl 2,5-dimethyl-1,3-thiazol-4-yl acetate,methyl 2-dimethyl-1,3-thiazol-4-yl acetate,acmc-1agna,4-thiazoleaceticacid, 2,5-dimethyl-, methyl ester,2,5-dimethyl-thiazol-4-yl-acetic acid methyl ester,2-2,5-dimethyl-4-thiazolyl acetic acid methyl ester,methyl 2-2,5-dimethyl-1,3-thiazol-4-yl ethanoate PubChem CID: 2801571 IUPAC Name: methyl 2-(2,5-dimethyl-1,3-thiazol-4-yl)acetate SMILES: CC1=C(N=C(S1)C)CC(=O)OC

PubChem CID 2801571
CAS 306937-37-1
Molecular Weight (g/mol) 185.241
MDL Number MFCD02677686
SMILES CC1=C(N=C(S1)C)CC(=O)OC
Synonym methyl 2-2,5-dimethyl-1,3-thiazol-4-yl acetate,methyl 2-2,5-dimethylthiazol-4-yl acetate,methyl 2,5-dimethyl-1,3-thiazol-4-yl acetate,methyl 2-dimethyl-1,3-thiazol-4-yl acetate,acmc-1agna,4-thiazoleaceticacid, 2,5-dimethyl-, methyl ester,2,5-dimethyl-thiazol-4-yl-acetic acid methyl ester,2-2,5-dimethyl-4-thiazolyl acetic acid methyl ester,methyl 2-2,5-dimethyl-1,3-thiazol-4-yl ethanoate
IUPAC Name methyl 2-(2,5-dimethyl-1,3-thiazol-4-yl)acetate
InChI Key AUEJOXGQRQYLDJ-UHFFFAOYSA-N
Molecular Formula C8H11NO2S