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N-substituted imidazoles
Description:
Heterocyclic compounds containing an imidazole ring substituted at position 1.
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4-(chloromethyl)-1-methylimidazoleCas Number: 112258-59-0 Compound CID: 12147488Formula: C5H7ClN2 Molecular Weight: 130.57IUPAC Name: 4-(chloromethyl)-1-methylimidazoleSMILES: CN1C=C(N=C1)CClInChIKey: QVAQFEBMXMVWJD-UHFFFAOYSA-NInChI: InChI=1S/C5H7ClN2/c1-8-3-5(2-6)7-4-8/h3-4H,2H2,1H3
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3-(Imidazo[2,1-b]thiazol-6-yl)propanoicacidhydrochlorideCas Number: 1187830-53-0 Compound CID: 50990940Formula: C8H9ClN2O2S Molecular Weight: 232.69IUPAC Name: 3-imidazo[2,1-b][1,3]thiazol-6-ylpropanoic acid;hydrochlorideSMILES: C1=CSC2=NC(=CN21)CCC(=O)O.ClInChIKey: UJNDEVZWVCCWCH-UHFFFAOYSA-NInChI: InChI=1S/C8H8N2O2S.ClH/c11-7(12)2-1-6-5-10-3-4-13-8(10)9-6;/h3-5H,1-2H2,(H,11,12);1H
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1-Dodecyl-3-Methylimidazolium TetrafluoroborateCas Number: 244193-59-7 Compound CID: 46226173Formula: C16H31BF4N2 Molecular Weight: 338.24IUPAC Name: 1-dodecyl-3-methylimidazol-3-ium;tetrafluoroborateSMILES: [B-](F)(F)(F)F.CCCCCCCCCCCCN1C=C[N+](=C1)CInChIKey: DXBLSHGDRZIBJZ-UHFFFAOYSA-NInChI: InChI=1S/C16H31N2.BF4/c1-3-4-5-6-7-8-9-10-11-12-13-18-15-14-17(2)16-18;2-1(3,4)5/h14-16H,3-13H2,1-2H3;/q+1;-1
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1-Decyl-3-Methylimidazolium HexafluorophosphateCas Number: 362043-46-7 Compound CID: 10044526Formula: C14H27F6N2P Molecular Weight: 368.34IUPAC Name: 1-decyl-3-methylimidazol-3-ium;hexafluorophosphateSMILES: CCCCCCCCCCN1C=C[N+](=C1)C.F[P-](F)(F)(F)(F)FInChIKey: OXZSRXCEZNETER-UHFFFAOYSA-NInChI: InChI=1S/C14H27N2.F6P/c1-3-4-5-6-7-8-9-10-11-16-13-12-15(2)14-16;1-7(2,3,4,5)6/h12-14H,3-11H2,1-2H3;/q+1;-1
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1-Cyclohexyl-1H-imidazoleCas Number: 67768-61-0 Compound CID: 10942619Formula: C9H14N2 Molecular Weight: 150.22IUPAC Name: 1-cyclohexylimidazoleSMILES: C1CCC(CC1)N2C=CN=C2InChIKey: VGZINEPOBWTUEH-UHFFFAOYSA-NInChI: InChI=1S/C9H14N2/c1-2-4-9(5-3-1)11-7-6-10-8-11/h6-9H,1-5H2
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3-Benzyl-1-dodecyl-2-methyl-1H-imidazol-3-ium chlorideCas Number: 21054-72-8Formula: C23H37ClN2 Molecular Weight: 377.01IUPAC Name: 1-benzyl-3-dodecyl-2-methylimidazol-1-ium;chlorideSMILES: CCCCCCCCCCCCN1C=C[N+](=C1C)CC2=CC=CC=C2.[Cl-]InChIKey: PBODPHKDNYVCEJ-UHFFFAOYSA-MInChI: InChI=1S/C23H37N2.ClH/c1-3-4-5-6-7-8-9-10-11-15-18-24-19-20-25(22(24)2)21-23-16-13-12-14-17-23;/h12-14,16-17,19-20H,3-11,15,18,21H2,1-2H3;1H/q+1;/p-1
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N-Ethyl-2-(1-imidazolyl)acetamideCas Number: 1204921-90-3 Compound CID: 52145876Formula: C7H11N3O Molecular Weight: 153.18IUPAC Name: N-ethyl-2-imidazol-1-ylacetamideSMILES: CCNC(=O)CN1C=CN=C1InChIKey: FOAGYUIZFKJABZ-UHFFFAOYSA-NInChI: InChI=1S/C7H11N3O/c1-2-9-7(11)5-10-4-3-8-6-10/h3-4,6H,2,5H2,1H3,(H,9,11)
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N-Ethyl-2-(1-imidazolyl)ethanamineCas Number: 1211472-59-1 Compound CID: 53211308Formula: C7H13N3 Molecular Weight: 139.19IUPAC Name: N-ethyl-2-imidazol-1-ylethanamineSMILES: CCNCCN1C=CN=C1InChIKey: NVYAUEUOIDPZCX-UHFFFAOYSA-NInChI: InChI=1S/C7H13N3/c1-2-8-3-5-10-6-4-9-7-10/h4,6-8H,2-3,5H2,1H3
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N-(2-Cyanoethyl)-imidazoleCas Number: 23996-53-4 Compound CID: 557278Formula: C6H7N3 Molecular Weight: 121.14IUPAC Name: 3-imidazol-1-ylpropanenitrileSMILES: C1=CN(C=N1)CCC#NInChIKey: XEQIISVRKIKCLQ-UHFFFAOYSA-NInChI: InChI=1S/C6H7N3/c7-2-1-4-9-5-3-8-6-9/h3,5-6H,1,4H2Synonyms: 3-(1H-Imidazol-1-yl)propanenitrile
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2-(1H-Imidazol-1-yl)acetohydrazideCas Number: 56563-00-9 Compound CID: 960605Formula: C5H8N4O Molecular Weight: 140.15IUPAC Name: 2-imidazol-1-ylacetohydrazideSMILES: C1=CN(C=N1)CC(=O)NNInChIKey: CNCNYKXWAPNJEP-UHFFFAOYSA-NInChI: InChI=1S/C5H8N4O/c6-8-5(10)3-9-2-1-7-4-9/h1-2,4H,3,6H2,(H,8,10)
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2-(1H-Imidazol-1-yl)propan-1-olCas Number: 191725-72-1 Compound CID: 109147Formula: C6H10N2O Molecular Weight: 126.16IUPAC Name: 2-imidazol-1-ylpropan-1-olSMILES: CC(CO)N1C=CN=C1InChIKey: ZEMKCDHZMTZUKJ-UHFFFAOYSA-NInChI: InChI=1S/C6H10N2O/c1-6(4-9)8-3-2-7-5-8/h2-3,5-6,9H,4H2,1H3
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2-(1-Methyl-1H-imidazol-2-yl)acetonitrileCas Number: 3984-53-0 Compound CID: 817716Formula: C6H7N3 Molecular Weight: 121.14IUPAC Name: 2-(1-methylimidazol-2-yl)acetonitrileSMILES: CN1C=CN=C1CC#NInChIKey: FCQJYRPVEODPHA-UHFFFAOYSA-NInChI: InChI=1S/C6H7N3/c1-9-5-4-8-6(9)2-3-7/h4-5H,2H2,1H3

