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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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856 – 870 of 6,965 results
856

2-Methyl-5-nitroimidazole-1-ethanol 99.0+%, TCI America™

CAS: 443-48-1 Molecular Formula: C6H9N3O3 Molecular Weight (g/mol): 171.156 MDL Number: MFCD00009750 InChI Key: VAOCPAMSLUNLGC-UHFFFAOYSA-N Synonym: metronidazole,metronidazol,flagyl,2-methyl-5-nitroimidazole-1-ethanol,anagiardil,trichazol,gineflavir,meronidal,metronidaz,novonidazol PubChem CID: 4173 ChEBI: CHEBI:6909 IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethanol SMILES: CC1=NC=C(N1CCO)[N+](=O)[O-]

PubChem CID 4173
CAS 443-48-1
Molecular Weight (g/mol) 171.156
ChEBI CHEBI:6909
MDL Number MFCD00009750
SMILES CC1=NC=C(N1CCO)[N+](=O)[O-]
Synonym metronidazole,metronidazol,flagyl,2-methyl-5-nitroimidazole-1-ethanol,anagiardil,trichazol,gineflavir,meronidal,metronidaz,novonidazol
IUPAC Name 2-(2-methyl-5-nitroimidazol-1-yl)ethanol
InChI Key VAOCPAMSLUNLGC-UHFFFAOYSA-N
Molecular Formula C6H9N3O3
857

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
858

2-Aminoimidazole Sulfate 98.0+%, TCI America™

CAS: 1450-93-7 Molecular Formula: C6H12N6O4S Molecular Weight (g/mol): 264.26 MDL Number: MFCD00013162 InChI Key: KUWRLKJYNASPQZ-UHFFFAOYSA-N Synonym: 2-aminoimidazole hemisulfate,1h-imidazol-2-amine sulfate 2:1,bis 1h-imidazol-2-amine ; sulfuric acid,2-aminoimidazole sulphate,bis 2-aminoimidazole sulfate,1h-imidazol-2-amine sulfurate,2-aminoimidazole sulfate 2:1,1h-imidazol-2-amine, sulfate 2:1,pubchem8378,aminoimidazole hemisulfate PubChem CID: 2734684 IUPAC Name: bis(1H-imidazol-2-amine); sulfuric acid SMILES: OS(O)(=O)=O.NC1=NC=CN1.NC1=NC=CN1

PubChem CID 2734684
CAS 1450-93-7
Molecular Weight (g/mol) 264.26
MDL Number MFCD00013162
SMILES OS(O)(=O)=O.NC1=NC=CN1.NC1=NC=CN1
Synonym 2-aminoimidazole hemisulfate,1h-imidazol-2-amine sulfate 2:1,bis 1h-imidazol-2-amine ; sulfuric acid,2-aminoimidazole sulphate,bis 2-aminoimidazole sulfate,1h-imidazol-2-amine sulfurate,2-aminoimidazole sulfate 2:1,1h-imidazol-2-amine, sulfate 2:1,pubchem8378,aminoimidazole hemisulfate
IUPAC Name bis(1H-imidazol-2-amine); sulfuric acid
InChI Key KUWRLKJYNASPQZ-UHFFFAOYSA-N
Molecular Formula C6H12N6O4S
859

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
860

1-Ethyl-3-methylimidazolium Dicyanamide 97.0+%, TCI America™

CAS: 370865-89-7 Molecular Formula: C8H11N5 Molecular Weight (g/mol): 177.211 InChI Key: MKHFCTXNDRMIDR-UHFFFAOYSA-N Synonym: 1-ethyl-3-methylimidazolium dicyanamide,ethylmethylimidazolium dicyanamide,emim dca,acmc-209iqn,basionics™ vs 03,dsstox_cid_27940,dsstox_rid_82692,dsstox_gsid_47964,ksc221g0h PubChem CID: 11159638 IUPAC Name: cyanoiminomethylideneazanide;1-ethyl-3-methylimidazol-3-ium SMILES: CCN1C=C[N+](=C1)C.C(=[N-])=NC#N

PubChem CID 11159638
CAS 370865-89-7
Molecular Weight (g/mol) 177.211
SMILES CCN1C=C[N+](=C1)C.C(=[N-])=NC#N
Synonym 1-ethyl-3-methylimidazolium dicyanamide,ethylmethylimidazolium dicyanamide,emim dca,acmc-209iqn,basionics™ vs 03,dsstox_cid_27940,dsstox_rid_82692,dsstox_gsid_47964,ksc221g0h
IUPAC Name cyanoiminomethylideneazanide;1-ethyl-3-methylimidazol-3-ium
InChI Key MKHFCTXNDRMIDR-UHFFFAOYSA-N
Molecular Formula C8H11N5
861

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
862

1-Ethyl-2,3-dimethylimidazolium Bis(trifluoromethanesulfonyl)imide 98.0+%, TCI America™

CAS: 174899-90-2 Molecular Formula: C9H13F6N3O4S2 Molecular Weight (g/mol): 405.33 InChI Key: XDJYSDBSJWNTQT-UHFFFAOYSA-N PubChem CID: 21932259 IUPAC Name: bis(trifluoromethylsulfonyl)azanide;1-ethyl-2,3-dimethylimidazol-3-ium SMILES: CCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

PubChem CID 21932259
CAS 174899-90-2
Molecular Weight (g/mol) 405.33
SMILES CCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
IUPAC Name bis(trifluoromethylsulfonyl)azanide;1-ethyl-2,3-dimethylimidazol-3-ium
InChI Key XDJYSDBSJWNTQT-UHFFFAOYSA-N
Molecular Formula C9H13F6N3O4S2
863

2,4-Diamino-6-[2-(2-undecyl-1-imidazolyl)ethyl]-1,3,5-triazine 99.0+%, TCI America™

CAS: 50729-75-4 Molecular Formula: C19H33N7 Molecular Weight (g/mol): 359.522 InChI Key: QZDGTFKTHGKXEP-UHFFFAOYSA-N PubChem CID: 162605 IUPAC Name: 6-[2-(2-undecylimidazol-1-yl)ethyl]-1,3,5-triazine-2,4-diamine SMILES: CCCCCCCCCCCC1=NC=CN1CCC2=NC(=NC(=N2)N)N

PubChem CID 162605
CAS 50729-75-4
Molecular Weight (g/mol) 359.522
SMILES CCCCCCCCCCCC1=NC=CN1CCC2=NC(=NC(=N2)N)N
IUPAC Name 6-[2-(2-undecylimidazol-1-yl)ethyl]-1,3,5-triazine-2,4-diamine
InChI Key QZDGTFKTHGKXEP-UHFFFAOYSA-N
Molecular Formula C19H33N7
864

1,3-Bis(2,6-diisopropylphenyl)imidazol-2-ylidene 98.0+%, TCI America™

CAS: 244187-81-3 Molecular Formula: C27H36N2 Molecular Weight (g/mol): 388.599 MDL Number: MFCD07781991 InChI Key: VYCIHDBIKGRENI-UHFFFAOYSA-N Synonym: IPr PubChem CID: 11271730 IUPAC Name: 1,3-bis[2,6-di(propan-2-yl)phenyl]-2H-imidazol-1-ium-2-ide SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)N2C=C[N+](=[C-]2)C3=C(C=CC=C3C(C)C)C(C)C

PubChem CID 11271730
CAS 244187-81-3
Molecular Weight (g/mol) 388.599
MDL Number MFCD07781991
SMILES CC(C)C1=C(C(=CC=C1)C(C)C)N2C=C[N+](=[C-]2)C3=C(C=CC=C3C(C)C)C(C)C
Synonym IPr
IUPAC Name 1,3-bis[2,6-di(propan-2-yl)phenyl]-2H-imidazol-1-ium-2-ide
InChI Key VYCIHDBIKGRENI-UHFFFAOYSA-N
Molecular Formula C27H36N2
865

1-Methyl-3-pentylimidazolium Bromide 98.0+%, TCI America™

CAS: 343851-31-0 Molecular Formula: C9H17BrN2 Molecular Weight (g/mol): 233.153 MDL Number: MFCD19382537 InChI Key: PXFKRXXEFJDOMO-UHFFFAOYSA-M Synonym: 1-Methyl-3-pentyl-1H-imidazol-3-ium Bromide PubChem CID: 10537569 IUPAC Name: 1-methyl-3-pentylimidazol-1-ium;bromide SMILES: CCCCCN1C=C[N+](=C1)C.[Br-]

PubChem CID 10537569
CAS 343851-31-0
Molecular Weight (g/mol) 233.153
MDL Number MFCD19382537
SMILES CCCCCN1C=C[N+](=C1)C.[Br-]
Synonym 1-Methyl-3-pentyl-1H-imidazol-3-ium Bromide
IUPAC Name 1-methyl-3-pentylimidazol-1-ium;bromide
InChI Key PXFKRXXEFJDOMO-UHFFFAOYSA-M
Molecular Formula C9H17BrN2
866

1-Methyl-3-propylimidazolium Iodide 97.0+%, TCI America™

CAS: 119171-18-5 Molecular Formula: C7H13IN2 Molecular Weight (g/mol): 252.10 MDL Number: MFCD08276385 InChI Key: IVCMUVGRRDWTDK-UHFFFAOYSA-M Synonym: 1-methyl-3-propylimidazolium iodide,1-propyl-3-methylimidazolium iodide,1-methyl-3-n-propylimidazolium iodide,1-methyl-3-propylimidazol-1-ium iodide,acmc-1c1fw,dsstox_cid_29063,dsstox_rid_83282,dsstox_gsid_49207,ksc491c6t,1-methyl-3-propylimidazoliumiodide PubChem CID: 12971008 IUPAC Name: 3-methyl-1-propyl-1H-imidazol-3-ium iodide SMILES: [I-].CCCN1C=C[N+](C)=C1

PubChem CID 12971008
CAS 119171-18-5
Molecular Weight (g/mol) 252.10
MDL Number MFCD08276385
SMILES [I-].CCCN1C=C[N+](C)=C1
Synonym 1-methyl-3-propylimidazolium iodide,1-propyl-3-methylimidazolium iodide,1-methyl-3-n-propylimidazolium iodide,1-methyl-3-propylimidazol-1-ium iodide,acmc-1c1fw,dsstox_cid_29063,dsstox_rid_83282,dsstox_gsid_49207,ksc491c6t,1-methyl-3-propylimidazoliumiodide
IUPAC Name 3-methyl-1-propyl-1H-imidazol-3-ium iodide
InChI Key IVCMUVGRRDWTDK-UHFFFAOYSA-M
Molecular Formula C7H13IN2
867

1-Butyl-3-methylimidazolium Trifluoroacetate 97.0+%, TCI America™

CAS: 174899-94-6 Molecular Formula: C10H15F3N2O2 Molecular Weight (g/mol): 252.237 MDL Number: MFCD08458921 InChI Key: QPDGLRRWSBZCHP-UHFFFAOYSA-M PubChem CID: 10125280 IUPAC Name: 1-butyl-3-methylimidazol-3-ium;2,2,2-trifluoroacetate SMILES: CCCCN1C=C[N+](=C1)C.C(=O)(C(F)(F)F)[O-]

PubChem CID 10125280
CAS 174899-94-6
Molecular Weight (g/mol) 252.237
MDL Number MFCD08458921
SMILES CCCCN1C=C[N+](=C1)C.C(=O)(C(F)(F)F)[O-]
IUPAC Name 1-butyl-3-methylimidazol-3-ium;2,2,2-trifluoroacetate
InChI Key QPDGLRRWSBZCHP-UHFFFAOYSA-M
Molecular Formula C10H15F3N2O2
868

2-Butyl-1H-imidazole-5-carboxaldehyde 98.0+%, TCI America™

CAS: 68282-49-5 Molecular Formula: C8H12N2O Molecular Weight (g/mol): 152.197 MDL Number: MFCD01075030 InChI Key: PTHGVOCFAZSNNA-UHFFFAOYSA-N Synonym: 2-butyl-1h-imidazole-4-carbaldehyde,2-butyl-5-formylimidazole,2-butyl-4-formylimidazole,2-butyl-4-imidazolyl formaldehyde,unii-u12g73sqsx,2-butyl-1h-imidazole-5-carboxaldehyde,u12g73sqsx,1h-imidazole-5-carboxaldehyde, 2-butyl,2-butylimidazole-4-carbaldehyde,2-butyl-3h-imidazole-4-carbaldehyde PubChem CID: 2735671 IUPAC Name: 2-butyl-1H-imidazole-5-carbaldehyde SMILES: CCCCC1=NC=C(N1)C=O

PubChem CID 2735671
CAS 68282-49-5
Molecular Weight (g/mol) 152.197
MDL Number MFCD01075030
SMILES CCCCC1=NC=C(N1)C=O
Synonym 2-butyl-1h-imidazole-4-carbaldehyde,2-butyl-5-formylimidazole,2-butyl-4-formylimidazole,2-butyl-4-imidazolyl formaldehyde,unii-u12g73sqsx,2-butyl-1h-imidazole-5-carboxaldehyde,u12g73sqsx,1h-imidazole-5-carboxaldehyde, 2-butyl,2-butylimidazole-4-carbaldehyde,2-butyl-3h-imidazole-4-carbaldehyde
IUPAC Name 2-butyl-1H-imidazole-5-carbaldehyde
InChI Key PTHGVOCFAZSNNA-UHFFFAOYSA-N
Molecular Formula C8H12N2O
869

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
870

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