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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 (7,176)
Imidazoles (5,818)
Pyrazoles (2,024)
Oxazoles (1,559)
Triazoles (659)
Oxadiazoles (456)
Isoxazoles (262)
Thiadiazoles (88)
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961 – 975 of 16,829 results
961

1-(Chloromethyl)-1H-benzotriazole 98.0+%, TCI America™

CAS: 54187-96-1 Molecular Formula: C7H6ClN3 Molecular Weight (g/mol): 167.60 MDL Number: MFCD00216649 InChI Key: VSEROABGEVRIRY-UHFFFAOYSA-N PubChem CID: 3328222 IUPAC Name: 1-(chloromethyl)-1H-1,2,3-benzotriazole SMILES: ClCN1N=NC2=CC=CC=C12

PubChem CID 3328222
CAS 54187-96-1
Molecular Weight (g/mol) 167.60
MDL Number MFCD00216649
SMILES ClCN1N=NC2=CC=CC=C12
IUPAC Name 1-(chloromethyl)-1H-1,2,3-benzotriazole
InChI Key VSEROABGEVRIRY-UHFFFAOYSA-N
Molecular Formula C7H6ClN3
962

1-(Trifluoromethanesulfonyl)-1H-benzotriazole 98.0+%, TCI America™

CAS: 117632-84-5 Molecular Formula: C7H4F3N3O2S Molecular Weight (g/mol): 251.18 MDL Number: MFCD00963686 InChI Key: QTTZLMGXPHZYKR-UHFFFAOYSA-N PubChem CID: 3692410 IUPAC Name: 1-trifluoromethanesulfonyl-1H-1,2,3-benzotriazole SMILES: FC(F)(F)S(=O)(=O)N1N=NC2=CC=CC=C12

PubChem CID 3692410
CAS 117632-84-5
Molecular Weight (g/mol) 251.18
MDL Number MFCD00963686
SMILES FC(F)(F)S(=O)(=O)N1N=NC2=CC=CC=C12
IUPAC Name 1-trifluoromethanesulfonyl-1H-1,2,3-benzotriazole
InChI Key QTTZLMGXPHZYKR-UHFFFAOYSA-N
Molecular Formula C7H4F3N3O2S
963

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
964

Ganciclovir Hydrate 98.0+%, TCI America™

CAS: 82410-32-0 Molecular Formula: C9H13N5O4 Molecular Weight (g/mol): 255.234 MDL Number: MFCD00870588 InChI Key: IRSCQMHQWWYFCW-UHFFFAOYSA-N Synonym: ganciclovir,gancyclovir,cytovene,vitrasert,hydroxyacyclovir,ganciclovirum,zirgan,ganciclovir sodium,cymevene,hhemg PubChem CID: 3454 ChEBI: CHEBI:465284 IUPAC Name: 2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)-3H-purin-6-one SMILES: C1=NC2=C(N1COC(CO)CO)NC(=NC2=O)N

PubChem CID 3454
CAS 82410-32-0
Molecular Weight (g/mol) 255.234
ChEBI CHEBI:465284
MDL Number MFCD00870588
SMILES C1=NC2=C(N1COC(CO)CO)NC(=NC2=O)N
Synonym ganciclovir,gancyclovir,cytovene,vitrasert,hydroxyacyclovir,ganciclovirum,zirgan,ganciclovir sodium,cymevene,hhemg
IUPAC Name 2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)-3H-purin-6-one
InChI Key IRSCQMHQWWYFCW-UHFFFAOYSA-N
Molecular Formula C9H13N5O4
965

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

CAS: 5496-32-2 Molecular Formula: C21H15ClN2 Molecular Weight (g/mol): 330.815 MDL Number: MFCD00030329 InChI Key: NJXBHEMXPUMJRO-UHFFFAOYSA-N PubChem CID: 794727 IUPAC Name: 2-(4-chlorophenyl)-4,5-diphenyl-1H-imidazole SMILES: C1=CC=C(C=C1)C2=C(N=C(N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

PubChem CID 794727
CAS 5496-32-2
Molecular Weight (g/mol) 330.815
MDL Number MFCD00030329
SMILES C1=CC=C(C=C1)C2=C(N=C(N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4
IUPAC Name 2-(4-chlorophenyl)-4,5-diphenyl-1H-imidazole
InChI Key NJXBHEMXPUMJRO-UHFFFAOYSA-N
Molecular Formula C21H15ClN2
966

1-Hexyl-2,3-dimethylimidazolium Iodide 98.0+%, TCI America™

CAS: 288627-94-1 Molecular Formula: C11H21IN2 Molecular Weight (g/mol): 308.207 InChI Key: YYXZQUOJBJOARI-UHFFFAOYSA-M PubChem CID: 53384397 IUPAC Name: 1-hexyl-2,3-dimethylimidazol-3-ium;iodide SMILES: CCCCCCN1C=C[N+](=C1C)C.[I-]

PubChem CID 53384397
CAS 288627-94-1
Molecular Weight (g/mol) 308.207
SMILES CCCCCCN1C=C[N+](=C1C)C.[I-]
IUPAC Name 1-hexyl-2,3-dimethylimidazol-3-ium;iodide
InChI Key YYXZQUOJBJOARI-UHFFFAOYSA-M
Molecular Formula C11H21IN2
967

1-(2-Cyanoethyl)-2-undecylimidazole 98.0+%, TCI America™

CAS: 23996-16-9 Molecular Formula: C17H29N3 Molecular Weight (g/mol): 275.44 InChI Key: SZUPZARBRLCVCB-UHFFFAOYSA-N Synonym: 3-(2-Undecyl-1-imidazolyl)propionitrile PubChem CID: 90326 IUPAC Name: 3-(2-undecylimidazol-1-yl)propanenitrile SMILES: CCCCCCCCCCCC1=NC=CN1CCC#N

PubChem CID 90326
CAS 23996-16-9
Molecular Weight (g/mol) 275.44
SMILES CCCCCCCCCCCC1=NC=CN1CCC#N
Synonym 3-(2-Undecyl-1-imidazolyl)propionitrile
IUPAC Name 3-(2-undecylimidazol-1-yl)propanenitrile
InChI Key SZUPZARBRLCVCB-UHFFFAOYSA-N
Molecular Formula C17H29N3
968

4-Nitroimidazole 98.0+%, TCI America™

CAS: 3034-38-6 Molecular Formula: C3H3N3O2 Molecular Weight (g/mol): 113.08 MDL Number: MFCD00005196 InChI Key: VYDWQPKRHOGLPA-UHFFFAOYSA-N Synonym: 4-nitroimidazole,4-nitro-1h-imidazole,1h-imidazole, 4-nitro,5-nitroimidazole,4 5-nitroimidazole,imidazole, 4-nitro,1h-imidazole, 5-nitro,unii-y8u32az5o7,5 4-nitroimidazole,4-nitro-3h-imidazole PubChem CID: 18208 ChEBI: CHEBI:64635 IUPAC Name: 5-nitro-1H-imidazole SMILES: [O-][N+](=O)C1=CN=CN1

PubChem CID 18208
CAS 3034-38-6
Molecular Weight (g/mol) 113.08
ChEBI CHEBI:64635
MDL Number MFCD00005196
SMILES [O-][N+](=O)C1=CN=CN1
Synonym 4-nitroimidazole,4-nitro-1h-imidazole,1h-imidazole, 4-nitro,5-nitroimidazole,4 5-nitroimidazole,imidazole, 4-nitro,1h-imidazole, 5-nitro,unii-y8u32az5o7,5 4-nitroimidazole,4-nitro-3h-imidazole
IUPAC Name 5-nitro-1H-imidazole
InChI Key VYDWQPKRHOGLPA-UHFFFAOYSA-N
Molecular Formula C3H3N3O2
969

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

CAS: 1019-85-8 Molecular Formula: C13H9ClN2 Molecular Weight (g/mol): 228.679 InChI Key: PTXUJRTVWRYYTE-UHFFFAOYSA-N Synonym: 2-4-chlorophenyl benzimidazole,2-4-chlorophenyl-1h-benzoimidazole,2-4-chlorophenyl-1h-benzimidazole,2-4-chloro-phenyl-1h-benzoimidazole,1h-benzimidazole, 2-4-chlorophenyl,2-4-chlorophenyl-1h-benzo d imidazole,2-4-chlorophenyl-1h-1,3-benzodiazole,acmc-2097xz,1h-benzimidazole,2-4-chlorophenyl PubChem CID: 759417 IUPAC Name: 2-(4-chlorophenyl)-1H-benzimidazole SMILES: C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)Cl

PubChem CID 759417
CAS 1019-85-8
Molecular Weight (g/mol) 228.679
SMILES C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)Cl
Synonym 2-4-chlorophenyl benzimidazole,2-4-chlorophenyl-1h-benzoimidazole,2-4-chlorophenyl-1h-benzimidazole,2-4-chloro-phenyl-1h-benzoimidazole,1h-benzimidazole, 2-4-chlorophenyl,2-4-chlorophenyl-1h-benzo d imidazole,2-4-chlorophenyl-1h-1,3-benzodiazole,acmc-2097xz,1h-benzimidazole,2-4-chlorophenyl
IUPAC Name 2-(4-chlorophenyl)-1H-benzimidazole
InChI Key PTXUJRTVWRYYTE-UHFFFAOYSA-N
Molecular Formula C13H9ClN2
970

1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate 98.0+%, TCI America™

CAS: 460345-16-8 Molecular Formula: C11H19F3N2O3S Molecular Weight (g/mol): 316.339 MDL Number: MFCD03427621 InChI Key: RABFGPMWVQNDHI-UHFFFAOYSA-M Synonym: 1-hexyl-3-methylimidazolium trifluoromethanesulfonate,1-hexyl-3-methylimidazolium trifluoromethansulfonate,1-hexyl-3-methylimidazolium triflate,hmim otf,dsstox_cid_27847,dsstox_rid_82600,dsstox_gsid_47871,ksc491c7h,1-hexyl-3-methylimidazoliumtrifluoromethansulfonate,1-hexyl-3-methyl-imidazol-3-ium; trifluoromethanesulfonate PubChem CID: 2734247 IUPAC Name: 1-hexyl-3-methylimidazol-3-ium;trifluoromethanesulfonate SMILES: CCCCCCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[O-]

PubChem CID 2734247
CAS 460345-16-8
Molecular Weight (g/mol) 316.339
MDL Number MFCD03427621
SMILES CCCCCCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[O-]
Synonym 1-hexyl-3-methylimidazolium trifluoromethanesulfonate,1-hexyl-3-methylimidazolium trifluoromethansulfonate,1-hexyl-3-methylimidazolium triflate,hmim otf,dsstox_cid_27847,dsstox_rid_82600,dsstox_gsid_47871,ksc491c7h,1-hexyl-3-methylimidazoliumtrifluoromethansulfonate,1-hexyl-3-methyl-imidazol-3-ium; trifluoromethanesulfonate
IUPAC Name 1-hexyl-3-methylimidazol-3-ium;trifluoromethanesulfonate
InChI Key RABFGPMWVQNDHI-UHFFFAOYSA-M
Molecular Formula C11H19F3N2O3S
971

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

CAS: 1707-67-1 Molecular Formula: C21H15ClN2 Molecular Weight (g/mol): 330.82 MDL Number: MFCD00030328 InChI Key: NSWNXQGJAPQOID-UHFFFAOYSA-N PubChem CID: 74356 IUPAC Name: 2-(2-chlorophenyl)-4,5-diphenyl-1H-imidazole SMILES: ClC1=CC=CC=C1C1=NC(=C(N1)C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 74356
CAS 1707-67-1
Molecular Weight (g/mol) 330.82
MDL Number MFCD00030328
SMILES ClC1=CC=CC=C1C1=NC(=C(N1)C1=CC=CC=C1)C1=CC=CC=C1
IUPAC Name 2-(2-chlorophenyl)-4,5-diphenyl-1H-imidazole
InChI Key NSWNXQGJAPQOID-UHFFFAOYSA-N
Molecular Formula C21H15ClN2
972

1-(2-Cyanoethyl)-2-methylimidazole 98.0+%, TCI America™

CAS: 23996-55-6 Molecular Formula: C7H9N3 Molecular Weight (g/mol): 135.17 InChI Key: SESYNEDUKZDRJL-UHFFFAOYSA-N Synonym: 3-(2-Methyl-1-imidazolyl)propionitrile PubChem CID: 90328 IUPAC Name: 3-(2-methylimidazol-1-yl)propanenitrile SMILES: CC1=NC=CN1CCC#N

PubChem CID 90328
CAS 23996-55-6
Molecular Weight (g/mol) 135.17
SMILES CC1=NC=CN1CCC#N
Synonym 3-(2-Methyl-1-imidazolyl)propionitrile
IUPAC Name 3-(2-methylimidazol-1-yl)propanenitrile
InChI Key SESYNEDUKZDRJL-UHFFFAOYSA-N
Molecular Formula C7H9N3
973

2-Phenyl-5-benzimidazolesulfonic Acid 95.0+%, TCI America™

CAS: 27503-81-7 Molecular Formula: C13H10N2O3S Molecular Weight (g/mol): 274.29 MDL Number: MFCD00053007 InChI Key: UVCJGUGAGLDPAA-UHFFFAOYSA-N Synonym: ensulizole,2-phenylbenzimidazole-5-sulfonic acid,phenylbenzimidazole sulfonic acid,2-phenyl-1h-benzo d imidazole-5-sulfonic acid,2-phenyl-1h-benzo d imidazole-6-sulfonic acid,1h-benzimidazole-5-sulfonic acid, 2-phenyl,unii-9yq9di1w42,2-phenyl-1h-benzimidazole-5-sulfonic acid,parsol hs,2-phenyl-5-benzimidazolesulfonic acid PubChem CID: 33919 IUPAC Name: 2-phenyl-1H-1,3-benzodiazole-6-sulfonic acid SMILES: OS(=O)(=O)C1=CC=C2N=C(NC2=C1)C1=CC=CC=C1

PubChem CID 33919
CAS 27503-81-7
Molecular Weight (g/mol) 274.29
MDL Number MFCD00053007
SMILES OS(=O)(=O)C1=CC=C2N=C(NC2=C1)C1=CC=CC=C1
Synonym ensulizole,2-phenylbenzimidazole-5-sulfonic acid,phenylbenzimidazole sulfonic acid,2-phenyl-1h-benzo d imidazole-5-sulfonic acid,2-phenyl-1h-benzo d imidazole-6-sulfonic acid,1h-benzimidazole-5-sulfonic acid, 2-phenyl,unii-9yq9di1w42,2-phenyl-1h-benzimidazole-5-sulfonic acid,parsol hs,2-phenyl-5-benzimidazolesulfonic acid
IUPAC Name 2-phenyl-1H-1,3-benzodiazole-6-sulfonic acid
InChI Key UVCJGUGAGLDPAA-UHFFFAOYSA-N
Molecular Formula C13H10N2O3S
974

Nizatidine 97.0+%, TCI America™

CAS: 76963-41-2 Molecular Formula: C12H21N5O2S2 Molecular Weight (g/mol): 331.453 MDL Number: MFCD00865660 InChI Key: SGXXNSQHWDMGGP-IZZDOVSWSA-N PubChem CID: 3033637 IUPAC Name: (E)-1-N'-[2-[[2-[(dimethylamino)methyl]-1,3-thiazol-4-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine SMILES: CNC(=C[N+](=O)[O-])NCCSCC1=CSC(=N1)CN(C)C

PubChem CID 3033637
CAS 76963-41-2
Molecular Weight (g/mol) 331.453
MDL Number MFCD00865660
SMILES CNC(=C[N+](=O)[O-])NCCSCC1=CSC(=N1)CN(C)C
IUPAC Name (E)-1-N'-[2-[[2-[(dimethylamino)methyl]-1,3-thiazol-4-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine
InChI Key SGXXNSQHWDMGGP-IZZDOVSWSA-N
Molecular Formula C12H21N5O2S2
975

1-Ethyl-3-methylimidazolium Iodide 98.0+%, TCI America™

CAS: 35935-34-3 Molecular Formula: C6H11IN2 Molecular Weight (g/mol): 238.07 MDL Number: MFCD03701101 InChI Key: IKQCDTXBZKMPBB-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium iodide,1-ethyl-3-methylimidazoliumiodide,1-ethyl-3-methyl-1h-imidazol-3-ium iodide,acmc-209ik2,dsstox_cid_29137,dsstox_rid_83356,dsstox_gsid_49281,ksc495i0n,1-ethyl-3-methyl imidazolium iodide salt PubChem CID: 11075478 IUPAC Name: 1-ethyl-3-methyl-1H-imidazol-3-ium iodide SMILES: [I-].CCN1C=C[N+](C)=C1

PubChem CID 11075478
CAS 35935-34-3
Molecular Weight (g/mol) 238.07
MDL Number MFCD03701101
SMILES [I-].CCN1C=C[N+](C)=C1
Synonym 1-ethyl-3-methylimidazolium iodide,1-ethyl-3-methylimidazoliumiodide,1-ethyl-3-methyl-1h-imidazol-3-ium iodide,acmc-209ik2,dsstox_cid_29137,dsstox_rid_83356,dsstox_gsid_49281,ksc495i0n,1-ethyl-3-methyl imidazolium iodide salt
IUPAC Name 1-ethyl-3-methyl-1H-imidazol-3-ium iodide
InChI Key IKQCDTXBZKMPBB-UHFFFAOYSA-M
Molecular Formula C6H11IN2