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N-substituted imidazoles
Description:
Heterocyclic compounds containing an imidazole ring substituted at position 1.
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1-Butyl-3-methylimidazolium methanesulfonateCas Number: 342789-81-5Formula: C9H18N2O3S Molecular Weight: 234.32IUPAC Name: 1-butyl-3-methylimidazol-3-ium;methanesulfonateSMILES: CCCCN1C=C[N+](=C1)C.CS(=O)(=O)[O-]InChIKey: PUHVBRXUKOGSBC-UHFFFAOYSA-MInChI: InChI=1S/C8H15N2.CH4O3S/c1-3-4-5-10-7-6-9(2)8-10;1-5(2,3)4/h6-8H,3-5H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1Synonyms: BASIONIC® ST 78 | Basionics ST 78, 1-n-Butyl-3-methylimidazolium methanesulfonate | BMIMMeSO3 -
6,7-Dihydro-5H-pyrrolo[1,2-a]imidazoleCas Number: 59646-16-1 Compound CID: 10441661Formula: C6H8N2 Molecular Weight: 108.14IUPAC Name: 6,7-dihydro-5H-pyrrolo[1,2-a]imidazoleSMILES: C1CC2=NC=CN2C1InChIKey: ZWETXQBHVRWLPW-UHFFFAOYSA-NInChI: InChI=1S/C6H8N2/c1-2-6-7-3-5-8(6)4-1/h3,5H,1-2,4H2 -
3-(1H-Imidazol-1-yl)propanamideCas Number: 43115-74-8 Compound CID: 14088730IUPAC Name: 3-imidazol-1-ylpropanamideSMILES: C1=CN(C=N1)CCC(=O)NInChIKey: VMQUSGWKCTXCRS-UHFFFAOYSA-NInChI: InChI=1S/C6H9N3O/c7-6(10)1-3-9-4-2-8-5-9/h2,4-5H,1,3H2,(H2,7,10)
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3-(1H-Imidazol-1-yl)propan-1-olCas Number: 51390-23-9 Compound CID: 4712271Formula: C6H10N2O Molecular Weight: 126.159IUPAC Name: 3-imidazol-1-ylpropan-1-olSMILES: C1=CN(C=N1)CCCOInChIKey: RYZVYLGJZFNBND-UHFFFAOYSA-NInChI: InChI=1S/C6H10N2O/c9-5-1-3-8-4-2-7-6-8/h2,4,6,9H,1,3,5H2
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1H-Imidazo[1,2-b]pyrazoleCas Number: 251-80-9 Compound CID: 159609Formula: C5H5N3 Molecular Weight: 107.11IUPAC Name: 5H-imidazo[1,2-b]pyrazoleSMILES: C1=CNN2C1=NC=C2InChIKey: MFGQIJCMHXZHHP-UHFFFAOYSA-NInChI: InChI=1S/C5H5N3/c1-2-7-8-4-3-6-5(1)8/h1-4,7H
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1-Methyl-1H-imidazole-5-boronic acidCas Number: 849062-28-8 Compound CID: 53407233Formula: C4H7BN2O2 Molecular Weight: 125.92IUPAC Name: (3-methylimidazol-4-yl)boronic acidSMILES: B(C1=CN=CN1C)(O)OInChIKey: DLUBTALXEVEGHN-UHFFFAOYSA-NInChI: InChI=1S/C4H7BN2O2/c1-7-3-6-2-4(7)5(8)9/h2-3,8-9H,1H3
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1-HexadecylimidazoleCas Number: 58175-55-6 Compound CID: 12415614Formula: C19H36N2 Molecular Weight: 292.5IUPAC Name: 1-hexadecylimidazoleSMILES: CCCCCCCCCCCCCCCCN1C=CN=C1InChIKey: ORIZJEOWAFVTGA-UHFFFAOYSA-NInChI: InChI=1S/C19H36N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-21-18-16-20-19-21/h16,18-19H,2-15,17H2,1H3
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1-Hexyl-2,3-dimethyl-1H-imidazol-3-ium chlorideCas Number: 455270-59-4 Compound CID: 2734169Formula: C11H21ClN2 Molecular Weight: 216.75IUPAC Name: 1-hexyl-2,3-dimethylimidazol-3-ium;chlorideSMILES: CCCCCCN1C=C[N+](=C1C)C.[Cl-]InChIKey: NCTQEXWJEPRHLV-UHFFFAOYSA-MInChI: InChI=1S/C11H21N2.ClH/c1-4-5-6-7-8-13-10-9-12(3)11(13)2;/h9-10H,4-8H2,1-3H3;1H/q+1;/p-1Synonyms: chloride | 1-hexyl-2,3-dimethylimidazol-3-ium | 1-Hexyl-2,3-dimethylimidazolium chloride
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1-(1H-Imidazol-1-yl)-N,N-dimethylmethanamineCas Number: 23230-39-9 Compound CID: 3832073Formula: C6H11N3 Molecular Weight: 125.17IUPAC Name: 1-imidazol-1-yl-N,N-dimethylmethanamineSMILES: CN(C)CN1C=CN=C1InChIKey: VANQIHUBDZAOOM-UHFFFAOYSA-NInChI: InChI=1S/C6H11N3/c1-8(2)6-9-4-3-7-5-9/h3-5H,6H2,1-2H3
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5-(Chloromethyl)-1-methyl-1H-imidazoleCas Number: 89180-90-5 Compound CID: 14239695Formula: C5H7ClN2 Molecular Weight: 130.57IUPAC Name: 5-(chloromethyl)-1-methylimidazoleSMILES: CN1C=NC=C1CClInChIKey: PECUDCBUFUGTTE-UHFFFAOYSA-NInChI: InChI=1S/C5H7ClN2/c1-8-4-7-3-5(8)2-6/h3-4H,2H2,1H3
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4-[(1-Imidazolyl)methyl]phenylboronic AcidCas Number: 1228183-01-4 Compound CID: 50990448Formula: C10H11BN2O2 Molecular Weight: 202.02IUPAC Name: [4-(imidazol-1-ylmethyl)phenyl]boronic acidSMILES: B(C1=CC=C(C=C1)CN2C=CN=C2)(O)OInChIKey: WOPRITIOYMANHW-UHFFFAOYSA-NInChI: InChI=1S/C10H11BN2O2/c14-11(15)10-3-1-9(2-4-10)7-13-6-5-12-8-13/h1-6,8,14-15H,7H2
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(1-Ethyl-1H-imidazol-5-yl)methanolCas Number: 215872-62-1 Compound CID: 22988641Formula: C6H10N2O Molecular Weight: 126.16IUPAC Name: (3-ethylimidazol-4-yl)methanolSMILES: CCN1C=NC=C1COInChIKey: FRNCAMZAPFINSG-UHFFFAOYSA-NInChI: InChI=1S/C6H10N2O/c1-2-8-5-7-3-6(8)4-9/h3,5,9H,2,4H2,1H3
