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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.
Imidazoles (2,977)
Thiazoles (2,012)
Pyrazoles (1,494)
Triazoles (583)
Oxazoles (552)
Oxadiazoles (244)
Isoxazoles (232)
Thiadiazoles (71)
Dithiazoles (4)

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31 – 45 of 6,945 results
31

1-Methylimidazole 99.0+%, TCI America™

CAS: 616-47-7 Molecular Formula: C4H6N2 Molecular Weight (g/mol): 82.11 MDL Number: MFCD00005292 InChI Key: MCTWTZJPVLRJOU-UHFFFAOYSA-N Synonym: 1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole PubChem CID: 1390 ChEBI: CHEBI:113454 IUPAC Name: 1-methyl-1H-imidazole SMILES: CN1C=CN=C1

PubChem CID 1390
CAS 616-47-7
Molecular Weight (g/mol) 82.11
ChEBI CHEBI:113454
MDL Number MFCD00005292
SMILES CN1C=CN=C1
Synonym 1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole
IUPAC Name 1-methyl-1H-imidazole
InChI Key MCTWTZJPVLRJOU-UHFFFAOYSA-N
Molecular Formula C4H6N2
32

5-Chlorobenzotriazole 98.0+%, TCI America™

CAS: 94-97-3 Molecular Formula: C6H4ClN3 Molecular Weight (g/mol): 153.57 MDL Number: MFCD00005700 InChI Key: PZBQVZFITSVHAW-UHFFFAOYSA-N Synonym: 5-chlorobenzotriazole,1h-benzotriazole, 5-chloro,6-chlorobenzotriazole,5-chloro-1h-benzotriazole,1h-benzotriazole, 6-chloro,5-chloro-1h-benzo d 1,2,3 triazole,5-chloro-1h-1,2,3-benzotriazole,6-chloro-1h-benzotriazole,unii-8c7o46g78k,5-chlorobenztriazole PubChem CID: 66760 IUPAC Name: 5-chloro-2H-1,2,3-benzotriazole SMILES: ClC1=CC2=NNN=C2C=C1

PubChem CID 66760
CAS 94-97-3
Molecular Weight (g/mol) 153.57
MDL Number MFCD00005700
SMILES ClC1=CC2=NNN=C2C=C1
Synonym 5-chlorobenzotriazole,1h-benzotriazole, 5-chloro,6-chlorobenzotriazole,5-chloro-1h-benzotriazole,1h-benzotriazole, 6-chloro,5-chloro-1h-benzo d 1,2,3 triazole,5-chloro-1h-1,2,3-benzotriazole,6-chloro-1h-benzotriazole,unii-8c7o46g78k,5-chlorobenztriazole
IUPAC Name 5-chloro-2H-1,2,3-benzotriazole
InChI Key PZBQVZFITSVHAW-UHFFFAOYSA-N
Molecular Formula C6H4ClN3
33

1-Propylimidazole 98.0+%, TCI America™

CAS: 35203-44-2 Molecular Formula: C6H10N2 Molecular Weight (g/mol): 110.16 MDL Number: MFCD00060494 InChI Key: IYVYLVCVXXCYRI-UHFFFAOYSA-N PubChem CID: 118785 IUPAC Name: 1-propylimidazole SMILES: CCCN1C=CN=C1

PubChem CID 118785
CAS 35203-44-2
Molecular Weight (g/mol) 110.16
MDL Number MFCD00060494
SMILES CCCN1C=CN=C1
IUPAC Name 1-propylimidazole
InChI Key IYVYLVCVXXCYRI-UHFFFAOYSA-N
Molecular Formula C6H10N2
34

1-Ethylimidazole 98.0+%, TCI America™

CAS: 7098-07-9 Molecular Formula: C5H8N2 Molecular Weight (g/mol): 96.13 MDL Number: MFCD00055389 InChI Key: IWDFHWZHHOSSGR-UHFFFAOYSA-N PubChem CID: 81540 IUPAC Name: 1-ethylimidazole SMILES: CCN1C=CN=C1

PubChem CID 81540
CAS 7098-07-9
Molecular Weight (g/mol) 96.13
MDL Number MFCD00055389
SMILES CCN1C=CN=C1
IUPAC Name 1-ethylimidazole
InChI Key IWDFHWZHHOSSGR-UHFFFAOYSA-N
Molecular Formula C5H8N2
35

Tinidazole 98.0+%, TCI America™

CAS: 19387-91-8 Molecular Formula: C8H13N3O4S Molecular Weight (g/mol): 247.27 MDL Number: MFCD00057217 InChI Key: HJLSLZFTEKNLFI-UHFFFAOYSA-N Synonym: 1-[2-(Ethylsulfonyl)ethyl]-2-methyl-5-nitroimidazole PubChem CID: 5479 ChEBI: CHEBI:63627 IUPAC Name: 1-[2-(ethanesulfonyl)ethyl]-2-methyl-5-nitro-1H-imidazole SMILES: CCS(=O)(=O)CCN1C(C)=NC=C1[N+]([O-])=O

PubChem CID 5479
CAS 19387-91-8
Molecular Weight (g/mol) 247.27
ChEBI CHEBI:63627
MDL Number MFCD00057217
SMILES CCS(=O)(=O)CCN1C(C)=NC=C1[N+]([O-])=O
Synonym 1-[2-(Ethylsulfonyl)ethyl]-2-methyl-5-nitroimidazole
IUPAC Name 1-[2-(ethanesulfonyl)ethyl]-2-methyl-5-nitro-1H-imidazole
InChI Key HJLSLZFTEKNLFI-UHFFFAOYSA-N
Molecular Formula C8H13N3O4S
36

2-methyl-1,3-oxazole-4-carbaldehyde, Thermo Scientific™

CAS: 113732-84-6 Molecular Formula: C5H5NO2 Molecular Weight (g/mol): 111.1 InChI Key: ARAUEWKXKTYCHZ-UHFFFAOYSA-N Synonym: 2-methyloxazole-4-carbaldehyde,2-methyl-oxazole-4-carbaldehyde,2-methyloxazole-4-carboxaldehyde,2-methyl-4-formyloxazole,4-oxazolecarboxaldehyde, 2-methyl,4-formyl-2-methyl-1,3-oxazole,2-methyl-1,3-oxazole-4-carboxaldehyde,acmc-20ai0d,2-methyl-4-oxazolecarbaldehyde PubChem CID: 11073372 IUPAC Name: 2-methyl-1,3-oxazole-4-carbaldehyde SMILES: CC1=NC(=CO1)C=O

PubChem CID 11073372
CAS 113732-84-6
Molecular Weight (g/mol) 111.1
SMILES CC1=NC(=CO1)C=O
Synonym 2-methyloxazole-4-carbaldehyde,2-methyl-oxazole-4-carbaldehyde,2-methyloxazole-4-carboxaldehyde,2-methyl-4-formyloxazole,4-oxazolecarboxaldehyde, 2-methyl,4-formyl-2-methyl-1,3-oxazole,2-methyl-1,3-oxazole-4-carboxaldehyde,acmc-20ai0d,2-methyl-4-oxazolecarbaldehyde
IUPAC Name 2-methyl-1,3-oxazole-4-carbaldehyde
InChI Key ARAUEWKXKTYCHZ-UHFFFAOYSA-N
Molecular Formula C5H5NO2
37

Nalidixic acid sodium salt

CAS: 5-8-3374 Molecular Formula: C12H11N2NaO3 Molecular Weight (g/mol): 254.22 InChI Key: ROKRAUFZFDQWLE-UHFFFAOYSA-M IUPAC Name: sodium 1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate SMILES: [Na+].CCN1C=C(C([O-])=O)C(=O)C2=CC=C(C)N=C12

CAS 5-8-3374
Molecular Weight (g/mol) 254.22
SMILES [Na+].CCN1C=C(C([O-])=O)C(=O)C2=CC=C(C)N=C12
IUPAC Name sodium 1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate
InChI Key ROKRAUFZFDQWLE-UHFFFAOYSA-M
Molecular Formula C12H11N2NaO3
38

N-Methyl-(4-methyl-2-phenyl-1,3-oxazol-5-ylmethyl)amine, 97%, Thermo Scientific™

CAS: 1031843-28-3 Molecular Formula: C12H14N2O Molecular Weight (g/mol): 202.257 MDL Number: MFCD11109322 InChI Key: XCBYKJIAOCVNGY-UHFFFAOYSA-N Synonym: n-methyl-4-methyl-2-phenyl-1,3-oxazol-5-ylmethyl amine,methyl 4-methyl-2-phenyl-1,3-oxazol-5-yl methyl amine,5-methylamino methyl-4-methyl-2-phenyl-1,3-oxazole,methyl 4-methyl-2-phenyl 1,3-oxazol-5-yl methyl amine,n-methyl-1-4-methyl-2-phenyl-1,3-oxazol-5-yl methanamine,n-methyl-1-4-methyl-2-phenyl-1,3-oxazol-5-yl methylamine PubChem CID: 33589464 IUPAC Name: N-methyl-1-(4-methyl-2-phenyl-1,3-oxazol-5-yl)methanamine SMILES: CC1=C(OC(=N1)C2=CC=CC=C2)CNC

PubChem CID 33589464
CAS 1031843-28-3
Molecular Weight (g/mol) 202.257
MDL Number MFCD11109322
SMILES CC1=C(OC(=N1)C2=CC=CC=C2)CNC
Synonym n-methyl-4-methyl-2-phenyl-1,3-oxazol-5-ylmethyl amine,methyl 4-methyl-2-phenyl-1,3-oxazol-5-yl methyl amine,5-methylamino methyl-4-methyl-2-phenyl-1,3-oxazole,methyl 4-methyl-2-phenyl 1,3-oxazol-5-yl methyl amine,n-methyl-1-4-methyl-2-phenyl-1,3-oxazol-5-yl methanamine,n-methyl-1-4-methyl-2-phenyl-1,3-oxazol-5-yl methylamine
IUPAC Name N-methyl-1-(4-methyl-2-phenyl-1,3-oxazol-5-yl)methanamine
InChI Key XCBYKJIAOCVNGY-UHFFFAOYSA-N
Molecular Formula C12H14N2O
39

2,5-Diphenyloxazole, 99%

CAS: 92-71-7 Molecular Formula: C15H11NO Molecular Weight (g/mol): 221.26 MDL Number: MFCD00005306 InChI Key: CNRNYORZJGVOSY-UHFFFAOYSA-N Synonym: 2,5-diphenyloxazole,oxazole, 2,5-diphenyl,tritosol,2,5-diphenyl-oxazole,ppo scintillator,dpo scintillator,usaf ek-6775,ppo van,ppo,ppo scintillator van PubChem CID: 7105 IUPAC Name: 2,5-diphenyl-1,3-oxazole SMILES: O1C(=CN=C1C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 7105
CAS 92-71-7
Molecular Weight (g/mol) 221.26
MDL Number MFCD00005306
SMILES O1C(=CN=C1C1=CC=CC=C1)C1=CC=CC=C1
Synonym 2,5-diphenyloxazole,oxazole, 2,5-diphenyl,tritosol,2,5-diphenyl-oxazole,ppo scintillator,dpo scintillator,usaf ek-6775,ppo van,ppo,ppo scintillator van
IUPAC Name 2,5-diphenyl-1,3-oxazole
InChI Key CNRNYORZJGVOSY-UHFFFAOYSA-N
Molecular Formula C15H11NO
40

4-Methyl-1,3-oxazole-5-carboxylic acid, 95%, Thermo Scientific™

CAS: 2510-32-9 Molecular Formula: C5H5NO3 Molecular Weight (g/mol): 127.099 InChI Key: ZIXUNDOOBLSXPE-UHFFFAOYSA-N Synonym: 4-methyloxazole-5-carboxylic acid,4-methyl-5-oxazolecarboxylic acid,5-oxazolecarboxylic acid, 4-methyl,4-methyl-oxazole-5-carboxylic acid,ksc205g3h,4-methyl-5-oxazolecarboxylicacid,4-methyl-oxazol-5-carboxylic acid,4-methoxyoxazole-5-carboxylic acid,5-oxazolecarboxylicacid, 4-methyl PubChem CID: 292311 IUPAC Name: 4-methyl-1,3-oxazole-5-carboxylic acid SMILES: CC1=C(OC=N1)C(=O)O

PubChem CID 292311
CAS 2510-32-9
Molecular Weight (g/mol) 127.099
SMILES CC1=C(OC=N1)C(=O)O
Synonym 4-methyloxazole-5-carboxylic acid,4-methyl-5-oxazolecarboxylic acid,5-oxazolecarboxylic acid, 4-methyl,4-methyl-oxazole-5-carboxylic acid,ksc205g3h,4-methyl-5-oxazolecarboxylicacid,4-methyl-oxazol-5-carboxylic acid,4-methoxyoxazole-5-carboxylic acid,5-oxazolecarboxylicacid, 4-methyl
IUPAC Name 4-methyl-1,3-oxazole-5-carboxylic acid
InChI Key ZIXUNDOOBLSXPE-UHFFFAOYSA-N
Molecular Formula C5H5NO3
41

Xanthane hydride, Thermo Scientific Chemicals

CAS: 6846-35-1 Molecular Formula: C2H2N2S3 Molecular Weight (g/mol): 150.23 InChI Key: YWZHEXZIISFIDA-UHFFFAOYSA-N IUPAC Name: 5-amino-3H-1,2,4-dithiazole-3-thione SMILES: NC1=NC(=S)SS1

CAS 6846-35-1
Molecular Weight (g/mol) 150.23
SMILES NC1=NC(=S)SS1
IUPAC Name 5-amino-3H-1,2,4-dithiazole-3-thione
InChI Key YWZHEXZIISFIDA-UHFFFAOYSA-N
Molecular Formula C2H2N2S3
42

3-(2-Pyridyl)-5-(4-pyridyl)-1,2,4-triazole, 99%, Thermo Scientific Chemicals

CAS: 36770-50-0 Molecular Formula: C12H9N5 Molecular Weight (g/mol): 223.239 MDL Number: MFCD00107797 InChI Key: WOFXUCJTFGKKIF-UHFFFAOYSA-N Synonym: 3-2-pyridyl-5-4-pyridyl-1,2,4-triazole,2-3-pyridin-4-yl-1h-1,2,4-triazol-5-yl pyridine,3-2-pyridyl-5-4-pyridyl-1h-1,2,4-triazole,2-3-4-pyridyl-1h-1,2,4-triazol-5-yl pyridine,2-5-pyridin-4-yl-1h-1,2,4-triazol-3-yl pyridine,2-5-4-pyridyl-1h-1,2,4-triazol-3-yl pyridine,acmc-1ah5x,3-2'-pyridyl-5-4-pyridyl-1,2,4-triazole PubChem CID: 2803172 IUPAC Name: 2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)pyridine SMILES: C1=CC=NC(=C1)C2=NC(=NN2)C3=CC=NC=C3

PubChem CID 2803172
CAS 36770-50-0
Molecular Weight (g/mol) 223.239
MDL Number MFCD00107797
SMILES C1=CC=NC(=C1)C2=NC(=NN2)C3=CC=NC=C3
Synonym 3-2-pyridyl-5-4-pyridyl-1,2,4-triazole,2-3-pyridin-4-yl-1h-1,2,4-triazol-5-yl pyridine,3-2-pyridyl-5-4-pyridyl-1h-1,2,4-triazole,2-3-4-pyridyl-1h-1,2,4-triazol-5-yl pyridine,2-5-pyridin-4-yl-1h-1,2,4-triazol-3-yl pyridine,2-5-4-pyridyl-1h-1,2,4-triazol-3-yl pyridine,acmc-1ah5x,3-2'-pyridyl-5-4-pyridyl-1,2,4-triazole
IUPAC Name 2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)pyridine
InChI Key WOFXUCJTFGKKIF-UHFFFAOYSA-N
Molecular Formula C12H9N5
43

Methyl 1H-indazole-6-carboxylate, 95%, Thermo Scientific™

CAS: 170487-40-8 Molecular Formula: C9H8N2O2 Molecular Weight (g/mol): 176.175 MDL Number: MFCD07371612 InChI Key: TUSICEWIXLMXEY-UHFFFAOYSA-N Synonym: 1h-indazole-6-carboxylic acid methyl ester,methyl indazole-6-carboxylate,indazole-6-carboxylic acid methyl ester,6-1h indazole carboxylic acid methyl ester,1h-indazole-6-carboxylic acid, methyl ester,pubchem18064,methyl indazole-6carboxylate,ksc494o4p,methyl-1h-indazole-6-carboxylate,2h-indazole-6-carboxylic acid methyl ester PubChem CID: 286535 IUPAC Name: methyl 1H-indazole-6-carboxylate SMILES: COC(=O)C1=CC2=C(C=C1)C=NN2

PubChem CID 286535
CAS 170487-40-8
Molecular Weight (g/mol) 176.175
MDL Number MFCD07371612
SMILES COC(=O)C1=CC2=C(C=C1)C=NN2
Synonym 1h-indazole-6-carboxylic acid methyl ester,methyl indazole-6-carboxylate,indazole-6-carboxylic acid methyl ester,6-1h indazole carboxylic acid methyl ester,1h-indazole-6-carboxylic acid, methyl ester,pubchem18064,methyl indazole-6carboxylate,ksc494o4p,methyl-1h-indazole-6-carboxylate,2h-indazole-6-carboxylic acid methyl ester
IUPAC Name methyl 1H-indazole-6-carboxylate
InChI Key TUSICEWIXLMXEY-UHFFFAOYSA-N
Molecular Formula C9H8N2O2
44

5-Amino-1H-indazole, 98%

CAS: 19335-11-6 Molecular Formula: C7H7N3 Molecular Weight (g/mol): 133.154 MDL Number: MFCD00037975 InChI Key: XBTOSRUBOXQWBO-UHFFFAOYSA-N Synonym: 5-aminoindazole,5-amino-1h-indazole,2h-indazol-5-amine,5-indazolamine,1h-indazole-5-amine,1h-indazol-5-ylamine,indazol-5-ylamine,1h-indazole, 5-amino,5-aminobenzopyrazole,5-amino-indazole PubChem CID: 88012 IUPAC Name: 1H-indazol-5-amine SMILES: C1=CC2=C(C=C1N)C=NN2

PubChem CID 88012
CAS 19335-11-6
Molecular Weight (g/mol) 133.154
MDL Number MFCD00037975
SMILES C1=CC2=C(C=C1N)C=NN2
Synonym 5-aminoindazole,5-amino-1h-indazole,2h-indazol-5-amine,5-indazolamine,1h-indazole-5-amine,1h-indazol-5-ylamine,indazol-5-ylamine,1h-indazole, 5-amino,5-aminobenzopyrazole,5-amino-indazole
IUPAC Name 1H-indazol-5-amine
InChI Key XBTOSRUBOXQWBO-UHFFFAOYSA-N
Molecular Formula C7H7N3
45

1H-Indazole-6-carboxylic acid, 97%

CAS: 704-91-6 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.15 MDL Number: MFCD06804571 InChI Key: DNCVTVVLMRHJCJ-UHFFFAOYSA-N Synonym: indazole-6-carboxylic acid,1h-indazole-6-carboxylicacid,6-carboxyindazole,6-carboxy-1h-indazole,6-indazolecarboxylic acid,ksc376q7p,1h-indazole-6-carboxylic acid,6-1h indazole carboxylic acid PubChem CID: 16227938 IUPAC Name: 1H-indazole-6-carboxylic acid SMILES: OC(=O)C1=CC=C2C=NNC2=C1

PubChem CID 16227938
CAS 704-91-6
Molecular Weight (g/mol) 162.15
MDL Number MFCD06804571
SMILES OC(=O)C1=CC=C2C=NNC2=C1
Synonym indazole-6-carboxylic acid,1h-indazole-6-carboxylicacid,6-carboxyindazole,6-carboxy-1h-indazole,6-indazolecarboxylic acid,ksc376q7p,1h-indazole-6-carboxylic acid,6-1h indazole carboxylic acid
IUPAC Name 1H-indazole-6-carboxylic acid
InChI Key DNCVTVVLMRHJCJ-UHFFFAOYSA-N
Molecular Formula C8H6N2O2