Azoles
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1,1'-Oxalyldiimidazole 95.0+%, TCI America™
CAS: 18637-83-7 Molecular Formula: C8H6N4O2 Molecular Weight (g/mol): 190.16 MDL Number: MFCD00043067 InChI Key: ONRNRVLJHFFBJG-UHFFFAOYSA-N Synonym: 1,1'-oxalyldiimidazole,1,2-di 1h-imidazol-1-yl ethane-1,2-dione,1h-imidazole, 1,1'-1,2-dioxo-1,2-ethanediyl bis,oxalic acid diimidazolide,1,2-di imidazol-1-yl ethane-1,2-dione,bis imidazol-1-yl ethane-1,2-dione,1,1-oxalyldiimidazole,acmc-1cacg,1,1'-oxalyl-diimidazol,1,1'-oxalyldi 1h-imidazole PubChem CID: 100439 IUPAC Name: bis(1H-imidazol-1-yl)ethane-1,2-dione SMILES: O=C(N1C=CN=C1)C(=O)N1C=CN=C1
| PubChem CID | 100439 |
|---|---|
| CAS | 18637-83-7 |
| Molecular Weight (g/mol) | 190.16 |
| MDL Number | MFCD00043067 |
| SMILES | O=C(N1C=CN=C1)C(=O)N1C=CN=C1 |
| Synonym | 1,1'-oxalyldiimidazole,1,2-di 1h-imidazol-1-yl ethane-1,2-dione,1h-imidazole, 1,1'-1,2-dioxo-1,2-ethanediyl bis,oxalic acid diimidazolide,1,2-di imidazol-1-yl ethane-1,2-dione,bis imidazol-1-yl ethane-1,2-dione,1,1-oxalyldiimidazole,acmc-1cacg,1,1'-oxalyl-diimidazol,1,1'-oxalyldi 1h-imidazole |
| IUPAC Name | bis(1H-imidazol-1-yl)ethane-1,2-dione |
| InChI Key | ONRNRVLJHFFBJG-UHFFFAOYSA-N |
| Molecular Formula | C8H6N4O2 |
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 |
2,4-Dimethylthiazole 99.0+%, TCI America™
CAS: 541-58-2 Molecular Formula: C5H7NS Molecular Weight (g/mol): 113.18 MDL Number: MFCD00014509 InChI Key: OBSLLHNATPQFMJ-UHFFFAOYSA-N Synonym: 2,4-dimethylthiazole,thiazole, 2,4-dimethyl,2,4-methylthiazole,2,4-dimethyl thiazole,unii-lht97038oa,2,4-dimethyl-thiazole,dimethylthiazol,zlchem 533,2,4 dimethylthiazole,2.4-dimethylthiazole PubChem CID: 10934 IUPAC Name: 2,4-dimethyl-1,3-thiazole SMILES: CC1=NC(C)=CS1
| PubChem CID | 10934 |
|---|---|
| CAS | 541-58-2 |
| Molecular Weight (g/mol) | 113.18 |
| MDL Number | MFCD00014509 |
| SMILES | CC1=NC(C)=CS1 |
| Synonym | 2,4-dimethylthiazole,thiazole, 2,4-dimethyl,2,4-methylthiazole,2,4-dimethyl thiazole,unii-lht97038oa,2,4-dimethyl-thiazole,dimethylthiazol,zlchem 533,2,4 dimethylthiazole,2.4-dimethylthiazole |
| IUPAC Name | 2,4-dimethyl-1,3-thiazole |
| InChI Key | OBSLLHNATPQFMJ-UHFFFAOYSA-N |
| Molecular Formula | C5H7NS |
6-Chloroimidazo[1,2-b]pyridazine 98.0+%, TCI America™
CAS: 6775-78-6 Molecular Formula: C6H4ClN3 Molecular Weight (g/mol): 153.569 MDL Number: MFCD07778345 InChI Key: MPZDNIJHHXRTIQ-UHFFFAOYSA-N PubChem CID: 138828 IUPAC Name: 6-chloroimidazo[1,2-b]pyridazine SMILES: C1=CC(=NN2C1=NC=C2)Cl
| PubChem CID | 138828 |
|---|---|
| CAS | 6775-78-6 |
| Molecular Weight (g/mol) | 153.569 |
| MDL Number | MFCD07778345 |
| SMILES | C1=CC(=NN2C1=NC=C2)Cl |
| IUPAC Name | 6-chloroimidazo[1,2-b]pyridazine |
| InChI Key | MPZDNIJHHXRTIQ-UHFFFAOYSA-N |
| Molecular Formula | C6H4ClN3 |
1-Decyl-3-methylimidazolium Bromide 98.0+%, TCI America™
CAS: 188589-32-4 Molecular Formula: C14H27BrN2 Molecular Weight (g/mol): 303.29 MDL Number: MFCD09038832 InChI Key: HOISBTKPPVRFDS-UHFFFAOYSA-M Synonym: 1-Decyl-3-methyl-1H-imidazol-3-ium Bromide PubChem CID: 22078297 IUPAC Name: 1-decyl-3-methyl-1H-imidazol-3-ium bromide SMILES: [Br-].CCCCCCCCCCN1C=C[N+](C)=C1
| PubChem CID | 22078297 |
|---|---|
| CAS | 188589-32-4 |
| Molecular Weight (g/mol) | 303.29 |
| MDL Number | MFCD09038832 |
| SMILES | [Br-].CCCCCCCCCCN1C=C[N+](C)=C1 |
| Synonym | 1-Decyl-3-methyl-1H-imidazol-3-ium Bromide |
| IUPAC Name | 1-decyl-3-methyl-1H-imidazol-3-ium bromide |
| InChI Key | HOISBTKPPVRFDS-UHFFFAOYSA-M |
| Molecular Formula | C14H27BrN2 |
Telmisartan 98.0+%, TCI America™
CAS: 144701-48-4 Molecular Formula: C33H30N4O2 Molecular Weight (g/mol): 514.629 MDL Number: MFCD00918125 InChI Key: RMMXLENWKUUMAY-UHFFFAOYSA-N Synonym: telmisartan,micardis,pritor,bibr 277,kinzalmono,bibr 277se,4'-1,7'-dimethyl-2'-propyl-1h,3'h-2,5'-bibenzo d imidazol-3'-yl methyl-1,1'-biphenyl-2-carboxylic acid,bibr-277,targit,telmisartan inn PubChem CID: 65999 ChEBI: CHEBI:9434 IUPAC Name: 2-[4-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoic acid SMILES: CCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5=NC6=CC=CC=C6N5C)C
| PubChem CID | 65999 |
|---|---|
| CAS | 144701-48-4 |
| Molecular Weight (g/mol) | 514.629 |
| ChEBI | CHEBI:9434 |
| MDL Number | MFCD00918125 |
| SMILES | CCCC1=NC2=C(C=C(C=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5=NC6=CC=CC=C6N5C)C |
| Synonym | telmisartan,micardis,pritor,bibr 277,kinzalmono,bibr 277se,4'-1,7'-dimethyl-2'-propyl-1h,3'h-2,5'-bibenzo d imidazol-3'-yl methyl-1,1'-biphenyl-2-carboxylic acid,bibr-277,targit,telmisartan inn |
| IUPAC Name | 2-[4-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoic acid |
| InChI Key | RMMXLENWKUUMAY-UHFFFAOYSA-N |
| Molecular Formula | C33H30N4O2 |
Dorsomorphin 97.0+%, TCI America™
CAS: 866405-64-3 Molecular Formula: C24H25N5O Molecular Weight (g/mol): 399.50 MDL Number: MFCD08705402 InChI Key: XHBVYDAKJHETMP-UHFFFAOYSA-N Synonym: 6-[4-(2-Piperidin-1-ylethoxy)phenyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyrimidine PubChem CID: 11524144 ChEBI: CHEBI:78510 IUPAC Name: 4-(6-{4-[2-(piperidin-1-yl)ethoxy]phenyl}pyrazolo[1,5-a]pyrimidin-3-yl)pyridine SMILES: C(CN1CCCCC1)OC1=CC=C(C=C1)C1=CN2N=CC(=C2N=C1)C1=CC=NC=C1
| PubChem CID | 11524144 |
|---|---|
| CAS | 866405-64-3 |
| Molecular Weight (g/mol) | 399.50 |
| ChEBI | CHEBI:78510 |
| MDL Number | MFCD08705402 |
| SMILES | C(CN1CCCCC1)OC1=CC=C(C=C1)C1=CN2N=CC(=C2N=C1)C1=CC=NC=C1 |
| Synonym | 6-[4-(2-Piperidin-1-ylethoxy)phenyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyrimidine |
| IUPAC Name | 4-(6-{4-[2-(piperidin-1-yl)ethoxy]phenyl}pyrazolo[1,5-a]pyrimidin-3-yl)pyridine |
| InChI Key | XHBVYDAKJHETMP-UHFFFAOYSA-N |
| Molecular Formula | C24H25N5O |
1-Ethyl-3-methylimidazolium Acetate 95.0+%, TCI America™
CAS: 143314-17-4 Molecular Formula: C8H14N2O2 Molecular Weight (g/mol): 170.212 MDL Number: MFCD06798186 InChI Key: XIYUIMLQTKODPS-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium acetate,basionic tm bc 01,emim ac,1-ethyl-3-methylimidazoliumacetate,basionics™ bc 01,acmc-1c26d,1h-imidazolium, 3-ethyl-1-methyl-, acetate 1:1,1-methyl-3-ethylimidazolium acetate,1-ethyl-3-methylimidazolium acetate hplc PubChem CID: 11658353 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;acetate SMILES: CCN1C=C[N+](=C1)C.CC(=O)[O-]
| PubChem CID | 11658353 |
|---|---|
| CAS | 143314-17-4 |
| Molecular Weight (g/mol) | 170.212 |
| MDL Number | MFCD06798186 |
| SMILES | CCN1C=C[N+](=C1)C.CC(=O)[O-] |
| Synonym | 1-ethyl-3-methylimidazolium acetate,basionic tm bc 01,emim ac,1-ethyl-3-methylimidazoliumacetate,basionics™ bc 01,acmc-1c26d,1h-imidazolium, 3-ethyl-1-methyl-, acetate 1:1,1-methyl-3-ethylimidazolium acetate,1-ethyl-3-methylimidazolium acetate hplc |
| IUPAC Name | 1-ethyl-3-methylimidazol-3-ium;acetate |
| InChI Key | XIYUIMLQTKODPS-UHFFFAOYSA-M |
| Molecular Formula | C8H14N2O2 |
1-Butyl-3-methylimidazolium Chloride 98.0+%, TCI America™
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CAS: 79917-90-1 Molecular Formula: C8H15ClN2 Molecular Weight (g/mol): 174.67 MDL Number: MFCD03095425 InChI Key: FHDQNOXQSTVAIC-UHFFFAOYSA-M Synonym: 1-butyl-3-methylimidazolium chloride,3-butyl-1-methyl-1h-imidazol-3-ium chloride,1-n-butyl-3-methylimidazolium chloride,bmimcl,bmim cl,c4mim chloride,dsstox_cid_11461,dsstox_rid_78878,dsstox_gsid_31461 PubChem CID: 2734161 IUPAC Name: 1-butyl-3-methyl-1H-imidazol-3-ium chloride SMILES: [Cl-].CCCCN1C=C[N+](C)=C1
| PubChem CID | 2734161 |
|---|---|
| CAS | 79917-90-1 |
| Molecular Weight (g/mol) | 174.67 |
| MDL Number | MFCD03095425 |
| SMILES | [Cl-].CCCCN1C=C[N+](C)=C1 |
| Synonym | 1-butyl-3-methylimidazolium chloride,3-butyl-1-methyl-1h-imidazol-3-ium chloride,1-n-butyl-3-methylimidazolium chloride,bmimcl,bmim cl,c4mim chloride,dsstox_cid_11461,dsstox_rid_78878,dsstox_gsid_31461 |
| IUPAC Name | 1-butyl-3-methyl-1H-imidazol-3-ium chloride |
| InChI Key | FHDQNOXQSTVAIC-UHFFFAOYSA-M |
| Molecular Formula | C8H15ClN2 |
1-Isopropylpyrazole 98.0+%, TCI America™
CAS: 18952-87-9 Molecular Formula: C6H10N2 Molecular Weight (g/mol): 110.16 MDL Number: MFCD07468920 InChI Key: ANMVTDVBEDVFRB-UHFFFAOYSA-N PubChem CID: 13469816 IUPAC Name: 1-(propan-2-yl)-1H-pyrazole SMILES: CC(C)N1C=CC=N1
| PubChem CID | 13469816 |
|---|---|
| CAS | 18952-87-9 |
| Molecular Weight (g/mol) | 110.16 |
| MDL Number | MFCD07468920 |
| SMILES | CC(C)N1C=CC=N1 |
| IUPAC Name | 1-(propan-2-yl)-1H-pyrazole |
| InChI Key | ANMVTDVBEDVFRB-UHFFFAOYSA-N |
| Molecular Formula | C6H10N2 |
3-Iodo-6-nitroindazole 98.0+%, TCI America™
CAS: 70315-70-7 Molecular Formula: C7H4IN3O2 Molecular Weight (g/mol): 289.03 MDL Number: MFCD07781652 InChI Key: GZCGNGLOCQEDMT-UHFFFAOYSA-N PubChem CID: 12475306 IUPAC Name: 3-iodo-6-nitro-2H-indazole SMILES: [O-][N+](=O)C1=CC2=NNC(I)=C2C=C1
| PubChem CID | 12475306 |
|---|---|
| CAS | 70315-70-7 |
| Molecular Weight (g/mol) | 289.03 |
| MDL Number | MFCD07781652 |
| SMILES | [O-][N+](=O)C1=CC2=NNC(I)=C2C=C1 |
| IUPAC Name | 3-iodo-6-nitro-2H-indazole |
| InChI Key | GZCGNGLOCQEDMT-UHFFFAOYSA-N |
| Molecular Formula | C7H4IN3O2 |
5-Acetyl-2-amino-4-methylthiazole 98.0+%, TCI America™
CAS: 30748-47-1 Molecular Formula: C6H8N2OS Molecular Weight (g/mol): 156.203 MDL Number: MFCD00051952 InChI Key: PKUKCASRNJIQNU-UHFFFAOYSA-N Synonym: 2-amino-4-methyl-5-acetylthiazole,1-2-amino-4-methylthiazol-5-yl ethanone,1-2-amino-4-methyl-1,3-thiazol-5-yl ethanone,5-acetyl-2-amino-4-methylthiazole,1-2-amino-4-methyl-1,3-thiazol-5-yl ethan-1-one,1-2-amino-4-methyl-thiazol-5-yl-ethanone,5-acetyl-2-amino-4-methyl-1,3-thiazole,ethanone, 1-2-amino-4-methyl-5-thiazolyl,1-2-amino-4-methyl-1,3-thiazol-5-yl-1-ethanone,5-acetyl-4-methyl-2-thiazolamine PubChem CID: 720882 IUPAC Name: 1-(2-amino-4-methyl-1,3-thiazol-5-yl)ethanone SMILES: CC1=C(SC(=N1)N)C(=O)C
| PubChem CID | 720882 |
|---|---|
| CAS | 30748-47-1 |
| Molecular Weight (g/mol) | 156.203 |
| MDL Number | MFCD00051952 |
| SMILES | CC1=C(SC(=N1)N)C(=O)C |
| Synonym | 2-amino-4-methyl-5-acetylthiazole,1-2-amino-4-methylthiazol-5-yl ethanone,1-2-amino-4-methyl-1,3-thiazol-5-yl ethanone,5-acetyl-2-amino-4-methylthiazole,1-2-amino-4-methyl-1,3-thiazol-5-yl ethan-1-one,1-2-amino-4-methyl-thiazol-5-yl-ethanone,5-acetyl-2-amino-4-methyl-1,3-thiazole,ethanone, 1-2-amino-4-methyl-5-thiazolyl,1-2-amino-4-methyl-1,3-thiazol-5-yl-1-ethanone,5-acetyl-4-methyl-2-thiazolamine |
| IUPAC Name | 1-(2-amino-4-methyl-1,3-thiazol-5-yl)ethanone |
| InChI Key | PKUKCASRNJIQNU-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2OS |
2-Amino-5-phenyl-1,3,4-oxadiazole 97.0+%, TCI America™
CAS: 1612-76-6 Molecular Formula: C8H7N3O Molecular Weight (g/mol): 161.16 MDL Number: MFCD00126383 InChI Key: CQSFYCBGVMWPCM-UHFFFAOYSA-N PubChem CID: 15363 IUPAC Name: 5-phenyl-1,3,4-oxadiazol-2-amine SMILES: NC1=NN=C(O1)C1=CC=CC=C1
| PubChem CID | 15363 |
|---|---|
| CAS | 1612-76-6 |
| Molecular Weight (g/mol) | 161.16 |
| MDL Number | MFCD00126383 |
| SMILES | NC1=NN=C(O1)C1=CC=CC=C1 |
| IUPAC Name | 5-phenyl-1,3,4-oxadiazol-2-amine |
| InChI Key | CQSFYCBGVMWPCM-UHFFFAOYSA-N |
| Molecular Formula | C8H7N3O |
NBD-COCl 92.0+%, TCI America™
CAS: 140164-85-8 Molecular Formula: C9H7ClN4O4 Molecular Weight (g/mol): 270.629 MDL Number: MFCD02093432 InChI Key: BLKGIXBLRWZLKS-UHFFFAOYSA-N Synonym: 4-(N-Chloroformylmethyl-N-methylamino)-7-nitro-2,1,3-benzoxadiazole PubChem CID: 23146122 IUPAC Name: 2-[methyl-(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]acetyl chloride SMILES: CN(CC(=O)Cl)C1=CC=C(C2=NON=C12)[N+](=O)[O-]
| PubChem CID | 23146122 |
|---|---|
| CAS | 140164-85-8 |
| Molecular Weight (g/mol) | 270.629 |
| MDL Number | MFCD02093432 |
| SMILES | CN(CC(=O)Cl)C1=CC=C(C2=NON=C12)[N+](=O)[O-] |
| Synonym | 4-(N-Chloroformylmethyl-N-methylamino)-7-nitro-2,1,3-benzoxadiazole |
| IUPAC Name | 2-[methyl-(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]acetyl chloride |
| InChI Key | BLKGIXBLRWZLKS-UHFFFAOYSA-N |
| Molecular Formula | C9H7ClN4O4 |
1-Butyl-2,3-dimethylimidazolium Trifluoromethanesulfonate 98.0+%, TCI America™
CAS: 765910-73-4 Molecular Formula: C10H17F3N2O3S Molecular Weight (g/mol): 302.312 MDL Number: MFCD03427624 InChI Key: KSOGGGZFEJTGPZ-UHFFFAOYSA-M Synonym: 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate,1-butyl-2,3-dimethylimidazolium triflate,dsstox_cid_29315,dsstox_rid_83431,dsstox_gsid_49356,ksc496s6h,1-butyl-2,3-dimethylimidazol-1-ium triflate,3-butyl-1,2-dimethylimidazol-1-ium triflate,1-butyl-2,3-dimethylimidazolium trifluoromethansulfonate,1-butyl-2,3-dimethylimidazol-3-ium; trifluoromethanesulfonate PubChem CID: 2734250 IUPAC Name: 1-butyl-2,3-dimethylimidazol-3-ium;trifluoromethanesulfonate SMILES: CCCCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[O-]
| PubChem CID | 2734250 |
|---|---|
| CAS | 765910-73-4 |
| Molecular Weight (g/mol) | 302.312 |
| MDL Number | MFCD03427624 |
| SMILES | CCCCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[O-] |
| Synonym | 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate,1-butyl-2,3-dimethylimidazolium triflate,dsstox_cid_29315,dsstox_rid_83431,dsstox_gsid_49356,ksc496s6h,1-butyl-2,3-dimethylimidazol-1-ium triflate,3-butyl-1,2-dimethylimidazol-1-ium triflate,1-butyl-2,3-dimethylimidazolium trifluoromethansulfonate,1-butyl-2,3-dimethylimidazol-3-ium; trifluoromethanesulfonate |
| IUPAC Name | 1-butyl-2,3-dimethylimidazol-3-ium;trifluoromethanesulfonate |
| InChI Key | KSOGGGZFEJTGPZ-UHFFFAOYSA-M |
| Molecular Formula | C10H17F3N2O3S |