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Substituted imidazoles
Description:
Heterocyclic compounds containing an imidazole ring substituted at one or more positions.
Ancestors:
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6，7-Dihydro-5H-pyrrolo[1，2-a]imidazol-6-olCas Number: 1378606-06-4 Compound CID: 67356950Formula: C6H8N2O Molecular Weight: 124.14IUPAC Name: 6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-6-olSMILES: C1C(CN2C1=NC=C2)OInChIKey: OLXNUSXUUWAEGE-UHFFFAOYSA-NInChI: InChI=1S/C6H8N2O/c9-5-3-6-7-1-2-8(6)4-5/h1-2,5,9H,3-4H2 -
4-Bromo-1-methylimidazole-2-carbaldehydeCas Number: 79326-91-3Formula: C5H5BrN2O Molecular Weight: 189.01SMILES: CN1C=C(N=C1C=O)BrInChIKey: AKEVNYPMPMIJPW-UHFFFAOYSA-NInChI: InChI=1S/C5H5BrN2O/c1-8-2-4(6)7-5(8)3-9/h2-3H,1H3
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3-methyl-1-vinyl-1H-imidazolium methyl sulphateCas Number: 26591-72-0Formula: C7H14N2O4S Molecular Weight: 222.2621SMILES: C[N+]1=CN(C=C1)C=C.COS(=O)(=O)[O-]InChIKey: BZVFPIHTRLNAQA-UHFFFAOYSA-MInChI: InChI=1S/C6H9N2.CH4O4S/c1-3-8-5-4-7(2)6-8;1-5-6(2,3)4/h3-6H,1H2,2H3;1H3,(H,2,3,4)/q+1;/p-1
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3-(1H-IMidazol-2-yl)propanoic acid hydrochlorideIUPAC Name: 3-(1H-imidazol-2-yl)propanoic acid;hydrochlorideSMILES: C1=CN=C(N1)CCC(=O)O.ClInChIKey: FNFOMFMVOHBKHO-UHFFFAOYSA-NInChI: InChI=1S/C6H8N2O2.ClH/c9-6(10)2-1-5-7-3-4-8-5;/h3-4H,1-2H2,(H,7,8)(H,9,10);1H
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2-(5-Nitro-1H-imidazol-1-yl)ethanolCas Number: 5006-68-8 Compound CID: 3248693Formula: C5H7N3O3IUPAC Name: 2-(5-nitroimidazol-1-yl)ethanolSMILES: C1=C(N(C=N1)CCO)[N+](=O)[O-]InChIKey: DFMZECOLZRIPOT-UHFFFAOYSA-NInChI: InChI=1S/C5H7N3O3/c9-2-1-7-4-6-3-5(7)8(10)11/h3-4,9H,1-2H2
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1，1'-Dimethyl-1H，1'H-2，2'-biimidazoleCas Number: 37570-94-8 Compound CID: 10123778Formula: C8H10N4 Molecular Weight: 162.19IUPAC Name: 1-methyl-2-(1-methylimidazol-2-yl)imidazoleSMILES: CN1C=CN=C1C2=NC=CN2CInChIKey: KMRPQHUALQQSPI-UHFFFAOYSA-NInChI: InChI=1S/C8H10N4/c1-11-5-3-9-7(11)8-10-4-6-12(8)2/h3-6H,1-2H3
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1，2-Bis(1-methyl-1H-imidazol-2-yl)disulfaneCas Number: 61747-29-3 Compound CID: 12297468Formula: C8H10N4S2 Molecular Weight: 226.3IUPAC Name: 1-methyl-2-[(1-methylimidazol-2-yl)disulfanyl]imidazoleSMILES: CN1C=CN=C1SSC2=NC=CN2CInChIKey: VWGKCNYHKYTHBR-UHFFFAOYSA-NInChI: InChI=1S/C8H10N4S2/c1-11-5-3-9-7(11)13-14-8-10-4-6-12(8)2/h3-6H,1-2H3
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1H-Imidazole-2-acetic acid， α-methyl-Cas Number: 1492007-00-7Formula: C6H8N2O2 Molecular Weight: 140.1399SMILES: CC(C1=NC=CN1)C(=O)OInChIKey: AJDNKVINGDHHEY-UHFFFAOYSA-NInChI: InChI=1S/C6H8N2O2/c1-4(6(9)10)5-7-2-3-8-5/h2-4H,1H3,(H,7,8)(H,9,10)
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1-Methyl-3-tetradecyl-1H-imidazol-3-ium chlorideCas Number: 171058-21-2Formula: C18H35ClN2 Molecular Weight: 314.94IUPAC Name: 1-methyl-3-tetradecylimidazol-1-ium;chlorideSMILES: CCCCCCCCCCCCCCN1C=C[N+](=C1)C.[Cl-]InChIKey: SDXDXENAFAXVMX-UHFFFAOYSA-MInChI: InChI=1S/C18H35N2.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20-17-16-19(2)18-20;/h16-18H,3-15H2,1-2H3;1H/q+1;/p-1Synonyms: 1-Tetradecyl-3-methylimidazolium chloride | 1-Methyl-3-tetradecylimidazolium chloride | DTXSID1049229 | DTXCID7029085...
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1-hexadecyl-3-methylimidazol-3-ium，tetrafluoroborateCas Number: 244193-64-4 Compound CID: 18506491Formula: 20H39N2·BF4IUPAC Name: 1-hexadecyl-3-methylimidazol-3-ium;tetrafluoroborateSMILES: [B-](F)(F)(F)F.CCCCCCCCCCCCCCCCN1C=C[N+](=C1)CInChIKey: WXCIBNGOVJQXTI-UHFFFAOYSA-NInChI: InChI=1S/C20H39N2.BF4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-19-18-21(2)20-22;2-1(3,4)5/h18-20H,3-17H2,1-2H3;/q+1;-1
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(2-Butyl-4-chloro-1H-imidazol-5-yl)methanolCas Number: 79047-41-9 Compound CID: 2735662Formula: C8H13ClN2O Molecular Weight: 188.65IUPAC Name: (2-butyl-4-chloro-1H-imidazol-5-yl)methanolSMILES: CCCCC1=NC(=C(N1)CO)ClInChIKey: DXSZKDOOHOBZMT-UHFFFAOYSA-NInChI: InChI=1S/C8H13ClN2O/c1-2-3-4-7-10-6(5-12)8(9)11-7/h12H,2-5H2,1H3,(H,10,11)Synonyms: 2-Butyl-4-chloroimidazole-5-methanol | 2-n-Butyl-4-chloro-5-(hydroxymethyl)imidazole | 5-Chloro-2-butylimidazole-4-me...
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1-Ethyl-3-methylimidazolium NitrateCas Number: 143314-14-1Formula: C6H11N3O3 Molecular Weight: 173.17IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;nitrateSMILES: CCN1C=C[N+](=C1)C.[N+](=O)([O-])[O-]InChIKey: JDOJFSVGXRJFLL-UHFFFAOYSA-NInChI: InChI=1S/C6H11N2.NO3/c1-3-8-5-4-7(2)6-8;2-1(3)4/h4-6H,3H2,1-2H3;/q+1;-1Synonyms: EMIMNO|3
