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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 (2,982)
Thiazoles (2,025)
Pyrazoles (1,495)
Triazoles (582)
Oxazoles (556)
Oxadiazoles (242)
Isoxazoles (232)
Thiadiazoles (71)
Dithiazoles (4)

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751 – 765 of 6,965 results
751

2-(4-Fluorophenyl)-4,5-diphenylimidazole 98.0+%, TCI America™

CAS: 2284-96-0 Molecular Formula: C21H15FN2 Molecular Weight (g/mol): 314.36 MDL Number: MFCD00389667 InChI Key: NSXOBUOVKKFIHN-UHFFFAOYSA-N PubChem CID: 800028 IUPAC Name: 2-(4-fluorophenyl)-4,5-diphenyl-1H-imidazole SMILES: FC1=CC=C(C=C1)C1=NC(=C(N1)C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 800028
CAS 2284-96-0
Molecular Weight (g/mol) 314.36
MDL Number MFCD00389667
SMILES FC1=CC=C(C=C1)C1=NC(=C(N1)C1=CC=CC=C1)C1=CC=CC=C1
IUPAC Name 2-(4-fluorophenyl)-4,5-diphenyl-1H-imidazole
InChI Key NSXOBUOVKKFIHN-UHFFFAOYSA-N
Molecular Formula C21H15FN2
752

Ethyl 3,5-Dimethylisoxazole-4-carboxylate 98.0+%, TCI America™

CAS: 17147-42-1 Molecular Formula: C8H11NO3 Molecular Weight (g/mol): 169.18 MDL Number: MFCD00052557 InChI Key: OQRHVDXUJAQVNT-UHFFFAOYSA-N Synonym: ethyl 3,5-dimethylisoxazole-4-carboxylate,ethyl 3,5-dimethyl-4-isoxazolecarboxylate,3,5-dimethylisoxazole-4-carboxylic acid ethyl ester,4-isoxazolecarboxylic acid, 3,5-dimethyl-, ethyl ester,3,5-dimethyl-4-ethoxycarbonyl isoxazole,ethyl 3,5-dimethyl-isoxazole-4-carboxylate,acmc-1c48c,ethyldimethylisoxazolecarboxylate,4-carbethoxy-3,5-dimethylisoxazole,4-carboethoxy-3,5-dimethylisoxazole PubChem CID: 736348 IUPAC Name: ethyl 3,5-dimethyl-1,2-oxazole-4-carboxylate SMILES: CCOC(=O)C1=C(ON=C1C)C

PubChem CID 736348
CAS 17147-42-1
Molecular Weight (g/mol) 169.18
MDL Number MFCD00052557
SMILES CCOC(=O)C1=C(ON=C1C)C
Synonym ethyl 3,5-dimethylisoxazole-4-carboxylate,ethyl 3,5-dimethyl-4-isoxazolecarboxylate,3,5-dimethylisoxazole-4-carboxylic acid ethyl ester,4-isoxazolecarboxylic acid, 3,5-dimethyl-, ethyl ester,3,5-dimethyl-4-ethoxycarbonyl isoxazole,ethyl 3,5-dimethyl-isoxazole-4-carboxylate,acmc-1c48c,ethyldimethylisoxazolecarboxylate,4-carbethoxy-3,5-dimethylisoxazole,4-carboethoxy-3,5-dimethylisoxazole
IUPAC Name ethyl 3,5-dimethyl-1,2-oxazole-4-carboxylate
InChI Key OQRHVDXUJAQVNT-UHFFFAOYSA-N
Molecular Formula C8H11NO3
753

Azilsartan 98.0+%, TCI America™

CAS: 147403-03-0 Molecular Formula: C25H20N4O5 Molecular Weight (g/mol): 456.46 MDL Number: MFCD20278186 InChI Key: KGSXMPPBFPAXLY-UHFFFAOYSA-N Synonym: azilsartan,unii-f9nux55p23,azilsartan tak-536,chembl57242,2-ethoxy-1-2'-5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl biphenyl-4-yl methyl-1h-benzimidazole-7-carboxylic acid,1h-benzimidazole-7-carboxylic acid, 1-2'-2,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl 1,1'-biphenyl-4-yl methyl-2-ethoxy,1-2'-2,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl 1,1'-biphenyl-4-yl methyl-2-ethoxy-1h-benzimidazole-7-carboxylic acid,2-ethoxy-1-2'-5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl biphenyl-4-yl methyl-1h-benzo d imidazole-7-carboxylic acid,2-ethoxy-1-2'-4,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl biphenyl-4-yl methyl benzimidazole-7-carboxylic acid,2-ethoxy-3-4-2-5-oxo-2h-1,2,4-oxadiazol-3-yl phenyl phenyl methyl benzimidazole-4-carboxylic acid PubChem CID: 9825285 ChEBI: CHEBI:68850 IUPAC Name: 2-ethoxy-1-{[2'-(5-oxo-2,5-dihydro-1,2,4-oxadiazol-3-yl)-[1,1'-biphenyl]-4-yl]methyl}-1H-1,3-benzodiazole-7-carboxylic acid SMILES: CCOC1=NC2=CC=CC(C(O)=O)=C2N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NC(=O)ON1

PubChem CID 9825285
CAS 147403-03-0
Molecular Weight (g/mol) 456.46
ChEBI CHEBI:68850
MDL Number MFCD20278186
SMILES CCOC1=NC2=CC=CC(C(O)=O)=C2N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NC(=O)ON1
Synonym azilsartan,unii-f9nux55p23,azilsartan tak-536,chembl57242,2-ethoxy-1-2'-5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl biphenyl-4-yl methyl-1h-benzimidazole-7-carboxylic acid,1h-benzimidazole-7-carboxylic acid, 1-2'-2,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl 1,1'-biphenyl-4-yl methyl-2-ethoxy,1-2'-2,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl 1,1'-biphenyl-4-yl methyl-2-ethoxy-1h-benzimidazole-7-carboxylic acid,2-ethoxy-1-2'-5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl biphenyl-4-yl methyl-1h-benzo d imidazole-7-carboxylic acid,2-ethoxy-1-2'-4,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl biphenyl-4-yl methyl benzimidazole-7-carboxylic acid,2-ethoxy-3-4-2-5-oxo-2h-1,2,4-oxadiazol-3-yl phenyl phenyl methyl benzimidazole-4-carboxylic acid
IUPAC Name 2-ethoxy-1-{[2'-(5-oxo-2,5-dihydro-1,2,4-oxadiazol-3-yl)-[1,1'-biphenyl]-4-yl]methyl}-1H-1,3-benzodiazole-7-carboxylic acid
InChI Key KGSXMPPBFPAXLY-UHFFFAOYSA-N
Molecular Formula C25H20N4O5
754

2-(4-Bromophenyl)benzoxazole 98.0+%, TCI America™

CAS: 3164-13-4 Molecular Formula: C13H8BrNO Molecular Weight (g/mol): 274.12 MDL Number: MFCD00168898 InChI Key: RBVHJNZMSBQFDK-UHFFFAOYSA-N PubChem CID: 12846715 IUPAC Name: 2-(4-bromophenyl)-1,3-benzoxazole SMILES: BrC1=CC=C(C=C1)C1=NC2=CC=CC=C2O1

PubChem CID 12846715
CAS 3164-13-4
Molecular Weight (g/mol) 274.12
MDL Number MFCD00168898
SMILES BrC1=CC=C(C=C1)C1=NC2=CC=CC=C2O1
IUPAC Name 2-(4-bromophenyl)-1,3-benzoxazole
InChI Key RBVHJNZMSBQFDK-UHFFFAOYSA-N
Molecular Formula C13H8BrNO
755

Potassium 5-Methyl-1,3,4-oxadiazole-2-carboxylate 98.0+%, TCI America™

CAS: 888504-28-7 Molecular Formula: C4H3KN2O3 Molecular Weight (g/mol): 166.177 MDL Number: MFCD08060085 InChI Key: BRHMYHXNUGVBCU-UHFFFAOYSA-M Synonym: 5-Methyl-1,3,4-oxadiazole-2-carboxylic Acid Potassium Salt PubChem CID: 24820502 IUPAC Name: potassium;5-methyl-1,3,4-oxadiazole-2-carboxylate SMILES: CC1=NN=C(O1)C(=O)[O-].[K+]

PubChem CID 24820502
CAS 888504-28-7
Molecular Weight (g/mol) 166.177
MDL Number MFCD08060085
SMILES CC1=NN=C(O1)C(=O)[O-].[K+]
Synonym 5-Methyl-1,3,4-oxadiazole-2-carboxylic Acid Potassium Salt
IUPAC Name potassium;5-methyl-1,3,4-oxadiazole-2-carboxylate
InChI Key BRHMYHXNUGVBCU-UHFFFAOYSA-M
Molecular Formula C4H3KN2O3
756

1-Butyl-2,3-dimethylimidazolium Hexafluorophosphate 97.0+%, TCI America™

CAS: 227617-70-1 Molecular Formula: C9H17F6N2P Molecular Weight (g/mol): 298.21 MDL Number: MFCD03790877 InChI Key: JWFPQAXAGSAKRF-UHFFFAOYSA-N Synonym: 1-butyl-2,3-dimethylimidazolium hexafluorophosphate,1-butyl-2,3-dimethyl-1h-imidazol-3-ium hexafluorophosphate v,1-butyl-2,3-dimethylimidazol-1-ium hexafluorophosphate,3-butyl-1,2-dimethylimidazol-1-ium hexafluorophosphate,acmc-209fyn,bdmim pf6,c4c1mim pf6,c4mmim pf6,dsstox_cid_27883,dsstox_rid_82636 PubChem CID: 11243457 IUPAC Name: 1-butyl-2,3-dimethyl-1H-imidazol-3-ium; hexafluoro-λ⁵-phosphanuide SMILES: F[P-](F)(F)(F)(F)F.CCCCN1C=C[N+](C)=C1C

PubChem CID 11243457
CAS 227617-70-1
Molecular Weight (g/mol) 298.21
MDL Number MFCD03790877
SMILES F[P-](F)(F)(F)(F)F.CCCCN1C=C[N+](C)=C1C
Synonym 1-butyl-2,3-dimethylimidazolium hexafluorophosphate,1-butyl-2,3-dimethyl-1h-imidazol-3-ium hexafluorophosphate v,1-butyl-2,3-dimethylimidazol-1-ium hexafluorophosphate,3-butyl-1,2-dimethylimidazol-1-ium hexafluorophosphate,acmc-209fyn,bdmim pf6,c4c1mim pf6,c4mmim pf6,dsstox_cid_27883,dsstox_rid_82636
IUPAC Name 1-butyl-2,3-dimethyl-1H-imidazol-3-ium; hexafluoro-λ⁵-phosphanuide
InChI Key JWFPQAXAGSAKRF-UHFFFAOYSA-N
Molecular Formula C9H17F6N2P
757

1-Benzylimidazole 98.0+%, TCI America™

CAS: 4238-71-5 Molecular Formula: C10H10N2 Molecular Weight (g/mol): 158.20 MDL Number: MFCD00005296 InChI Key: KKKDZZRICRFGSD-UHFFFAOYSA-N Synonym: 1-benzyl-1h-imidazole,n-benzylimidazole,imidazole, 1-benzyl,benzylimidazole,1h-imidazole, 1-phenylmethyl,1-benzyl imidazole,ccris 5821,chembl14192,1bn,1-benzylimdazole PubChem CID: 77918 IUPAC Name: 1-benzyl-1H-imidazole SMILES: C(N1C=CN=C1)C1=CC=CC=C1

PubChem CID 77918
CAS 4238-71-5
Molecular Weight (g/mol) 158.20
MDL Number MFCD00005296
SMILES C(N1C=CN=C1)C1=CC=CC=C1
Synonym 1-benzyl-1h-imidazole,n-benzylimidazole,imidazole, 1-benzyl,benzylimidazole,1h-imidazole, 1-phenylmethyl,1-benzyl imidazole,ccris 5821,chembl14192,1bn,1-benzylimdazole
IUPAC Name 1-benzyl-1H-imidazole
InChI Key KKKDZZRICRFGSD-UHFFFAOYSA-N
Molecular Formula C10H10N2
758

DBD-CO-Hz 98.0+%, TCI America™

CAS: 179951-63-4 Molecular Formula: C11H16N6O4S Molecular Weight (g/mol): 328.35 MDL Number: MFCD01321128 InChI Key: CCERXXCKPHMFBQ-UHFFFAOYSA-N Synonym: 4-(N,N-Dimethylaminosulfonyl)-7-(N-hydrazinocarbonylmethyl-N-methyl)aminobenzofurazan, 4-(N,N-Dimethylaminosulfonyl)-7-(N-hydrazinocarbonylmethyl-N-methyl)amino-2,1,3-benzoxadiazole PubChem CID: 44630077 IUPAC Name: 7-{[(hydrazinecarbonyl)methyl](methyl)amino}-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamide SMILES: CN(C)S(=O)(=O)C1=CC=C(N(C)CC(=O)NN)C2=NON=C12

PubChem CID 44630077
CAS 179951-63-4
Molecular Weight (g/mol) 328.35
MDL Number MFCD01321128
SMILES CN(C)S(=O)(=O)C1=CC=C(N(C)CC(=O)NN)C2=NON=C12
Synonym 4-(N,N-Dimethylaminosulfonyl)-7-(N-hydrazinocarbonylmethyl-N-methyl)aminobenzofurazan, 4-(N,N-Dimethylaminosulfonyl)-7-(N-hydrazinocarbonylmethyl-N-methyl)amino-2,1,3-benzoxadiazole
IUPAC Name 7-{[(hydrazinecarbonyl)methyl](methyl)amino}-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamide
InChI Key CCERXXCKPHMFBQ-UHFFFAOYSA-N
Molecular Formula C11H16N6O4S
759

2-(4-Bromophenyl)benzimidazole 98.0+%, TCI America™

CAS: 2622-74-4 Molecular Formula: C13H9BrN2 Molecular Weight (g/mol): 273.13 MDL Number: MFCD00224360 InChI Key: YRWMGOSKROWAIT-UHFFFAOYSA-N Synonym: 2-4-bromophenyl benzimidazole,2-4-bromophenyl-1h-benzo d imidazole,2-4-bromophenyl-1h-benzimidazole,2-4-bromophenyl-1h-benzoimidazole,2-4-bromophenyl benzoimidazole,2-4-bromo-phenyl-1h-benzoimidazole,1h-benzimidazole, 2-4-bromophenyl,2-4-bromophenyl-1h-1,3-benzodiazole,acmc-209gpy,boron-mol bm885 PubChem CID: 286182 IUPAC Name: 2-(4-bromophenyl)-1H-1,3-benzodiazole SMILES: BrC1=CC=C(C=C1)C1=NC2=CC=CC=C2N1

PubChem CID 286182
CAS 2622-74-4
Molecular Weight (g/mol) 273.13
MDL Number MFCD00224360
SMILES BrC1=CC=C(C=C1)C1=NC2=CC=CC=C2N1
Synonym 2-4-bromophenyl benzimidazole,2-4-bromophenyl-1h-benzo d imidazole,2-4-bromophenyl-1h-benzimidazole,2-4-bromophenyl-1h-benzoimidazole,2-4-bromophenyl benzoimidazole,2-4-bromo-phenyl-1h-benzoimidazole,1h-benzimidazole, 2-4-bromophenyl,2-4-bromophenyl-1h-1,3-benzodiazole,acmc-209gpy,boron-mol bm885
IUPAC Name 2-(4-bromophenyl)-1H-1,3-benzodiazole
InChI Key YRWMGOSKROWAIT-UHFFFAOYSA-N
Molecular Formula C13H9BrN2
760

2-Amino-4-(4-chlorophenyl)-5-methylthiazole 98.0+%, TCI America™

CAS: 82632-77-7 Molecular Formula: C10H9ClN2S Molecular Weight (g/mol): 224.706 MDL Number: MFCD00731832 InChI Key: IEJGVSUOFMBPJU-UHFFFAOYSA-N PubChem CID: 667574 IUPAC Name: 4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-amine SMILES: CC1=C(N=C(S1)N)C2=CC=C(C=C2)Cl

PubChem CID 667574
CAS 82632-77-7
Molecular Weight (g/mol) 224.706
MDL Number MFCD00731832
SMILES CC1=C(N=C(S1)N)C2=CC=C(C=C2)Cl
IUPAC Name 4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-amine
InChI Key IEJGVSUOFMBPJU-UHFFFAOYSA-N
Molecular Formula C10H9ClN2S
761

6-Bromoindazole 98.0+%, TCI America™

CAS: 79762-54-2 Molecular Formula: C7H5BrN2 Molecular Weight (g/mol): 197.04 MDL Number: MFCD03265457 InChI Key: WMKDUJVLNZANRN-UHFFFAOYSA-N PubChem CID: 17842471 IUPAC Name: 6-bromo-1H-indazole SMILES: BrC1=CC=C2C=NNC2=C1

PubChem CID 17842471
CAS 79762-54-2
Molecular Weight (g/mol) 197.04
MDL Number MFCD03265457
SMILES BrC1=CC=C2C=NNC2=C1
IUPAC Name 6-bromo-1H-indazole
InChI Key WMKDUJVLNZANRN-UHFFFAOYSA-N
Molecular Formula C7H5BrN2
762

Febuxostat 97.0+%, TCI America™

CAS: 144060-53-7 Molecular Formula: C16H16N2O3S Molecular Weight (g/mol): 316.38 MDL Number: MFCD00871598 InChI Key: BQSJTQLCZDPROO-UHFFFAOYSA-N Synonym: febuxostat,adenuric,uloric,feburic,tmx 67,2-3-cyano-4-isobutoxyphenyl-4-methylthiazole-5-carboxylic acid,tmx-67,febuxostat usan,unii-101v0r1n2e,uloric tn PubChem CID: 134018 ChEBI: CHEBI:45943 IUPAC Name: 2-[3-cyano-4-(2-methylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid SMILES: CC(C)COC1=CC=C(C=C1C#N)C1=NC(C)=C(S1)C(O)=O

PubChem CID 134018
CAS 144060-53-7
Molecular Weight (g/mol) 316.38
ChEBI CHEBI:45943
MDL Number MFCD00871598
SMILES CC(C)COC1=CC=C(C=C1C#N)C1=NC(C)=C(S1)C(O)=O
Synonym febuxostat,adenuric,uloric,feburic,tmx 67,2-3-cyano-4-isobutoxyphenyl-4-methylthiazole-5-carboxylic acid,tmx-67,febuxostat usan,unii-101v0r1n2e,uloric tn
IUPAC Name 2-[3-cyano-4-(2-methylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid
InChI Key BQSJTQLCZDPROO-UHFFFAOYSA-N
Molecular Formula C16H16N2O3S
763

2-Amino-4-methylthiazole Hydrochloride 98.0+%, TCI America™

CAS: 6142-15-0 Molecular Formula: C4H7ClN2S Molecular Weight (g/mol): 150.62 MDL Number: MFCD00035214 InChI Key: WUMMJVLSXMYDRW-UHFFFAOYSA-N PubChem CID: 80240 IUPAC Name: hydrogen 4-methyl-1,3-thiazol-2-amine chloride SMILES: [H+].[Cl-].CC1=CSC(N)=N1

PubChem CID 80240
CAS 6142-15-0
Molecular Weight (g/mol) 150.62
MDL Number MFCD00035214
SMILES [H+].[Cl-].CC1=CSC(N)=N1
IUPAC Name hydrogen 4-methyl-1,3-thiazol-2-amine chloride
InChI Key WUMMJVLSXMYDRW-UHFFFAOYSA-N
Molecular Formula C4H7ClN2S
764

5-Mercapto-1H-1,2,3-triazole Sodium Salt 97.0+%, TCI America™

CAS: 59032-27-8 Molecular Formula: C2H2N3NaS Molecular Weight (g/mol): 123.109 MDL Number: MFCD00044799 InChI Key: HHGMADGROXARPN-UHFFFAOYSA-M Synonym: sodium 1,2,3-triazole-5-thiolate,5-mercapto-1,2,3-triazole monosodium salt,sodium 1h-1,2,3-triazol-5-ylsulfanide,1h-1,2,3-triazole-5-thiol sodium salt,1h-5-mercapto-1,2,3-triazole,sodium salt,tas:1h-1,2,3-triazole-4-thiol sodium salt,sodium 1h-1,2,3-triazole-4-thiolate,sodium 1h-1,2,3-triazole-5-thiolate,sodium 2h-1,2,3-triazole-4-thiolate,1h-1,2,3-triazole-4-thiol sodium salt PubChem CID: 23685427 IUPAC Name: sodium;2H-triazole-4-thiolate SMILES: C1=NNN=C1[S-].[Na+]

PubChem CID 23685427
CAS 59032-27-8
Molecular Weight (g/mol) 123.109
MDL Number MFCD00044799
SMILES C1=NNN=C1[S-].[Na+]
Synonym sodium 1,2,3-triazole-5-thiolate,5-mercapto-1,2,3-triazole monosodium salt,sodium 1h-1,2,3-triazol-5-ylsulfanide,1h-1,2,3-triazole-5-thiol sodium salt,1h-5-mercapto-1,2,3-triazole,sodium salt,tas:1h-1,2,3-triazole-4-thiol sodium salt,sodium 1h-1,2,3-triazole-4-thiolate,sodium 1h-1,2,3-triazole-5-thiolate,sodium 2h-1,2,3-triazole-4-thiolate,1h-1,2,3-triazole-4-thiol sodium salt
IUPAC Name sodium;2H-triazole-4-thiolate
InChI Key HHGMADGROXARPN-UHFFFAOYSA-M
Molecular Formula C2H2N3NaS
765

2,4-Dimethyloxazole 98.0+%, TCI America™

CAS: 7208-05-1 Molecular Formula: C5H7NO Molecular Weight (g/mol): 97.12 MDL Number: MFCD00234124 InChI Key: PSOZJOZKEVZLKZ-UHFFFAOYSA-N PubChem CID: 138961 IUPAC Name: 2,4-dimethyl-1,3-oxazole SMILES: CC1=COC(=N1)C

PubChem CID 138961
CAS 7208-05-1
Molecular Weight (g/mol) 97.12
MDL Number MFCD00234124
SMILES CC1=COC(=N1)C
IUPAC Name 2,4-dimethyl-1,3-oxazole
InChI Key PSOZJOZKEVZLKZ-UHFFFAOYSA-N
Molecular Formula C5H7NO