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Benzimidazoles
Description:
Organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).
Ancestors:
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tert-Butyl 2-amino-1H-benzo[d]imidazole-1-carboxylateCas Number: 1383133-23-0 Compound CID: 74788384Formula: C12H15N3O2 Molecular Weight: 233.27IUPAC Name: tert-butyl 2-aminobenzimidazole-1-carboxylateSMILES: CC(C)(C)OC(=O)N1C2=CC=CC=C2N=C1NInChIKey: XLOVZUNVXPPLKH-UHFFFAOYSA-NInChI: InChI=1S/C12H15N3O2/c1-12(2,3)17-11(16)15-9-7-5-4-6-8(9)14-10(15)13/h4-7H,1-3H3,(H2,13,14) -
[4-(1H-1，3-benzodiazol-2-yl)phenyl]methanamineCas Number: 36078-89-4Formula: C14H13N3 Molecular Weight: 223.2731SMILES: C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)CNInChIKey: CYUNYLCJTMEPPR-UHFFFAOYSA-NInChI: InChI=1S/C14H13N3/c15-9-10-5-7-11(8-6-10)14-16-12-3-1-2-4-13(12)17-14/h1-8H,9,15H2,(H,16,17)
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Triclabendazole sulfoxideCas Number: 100648-13-3 Compound CID: 127657Formula: C14H9Cl3N2O2S Molecular Weight: 375.66IUPAC Name: 6-chloro-5-(2,3-dichlorophenoxy)-2-methylsulfinyl-1H-benzimidazoleSMILES: CS(=O)C1=NC2=CC(=C(C=C2N1)Cl)OC3=C(C(=CC=C3)Cl)ClInChIKey: GABQPFWIQFRJSE-UHFFFAOYSA-NInChI: InChI=1S/C14H9Cl3N2O2S/c1-22(20)14-18-9-5-8(16)12(6-10(9)19-14)21-11-4-2-3-7(15)13(11)17/h2-6H,1H3,(H,18,19)
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Triclabendazole sulfoneCas Number: 106791-37-1 Compound CID: 10340439Formula: C14H9Cl3N2O3S Molecular Weight: 391.66IUPAC Name: 6-chloro-5-(2,3-dichlorophenoxy)-2-methylsulfonyl-1H-benzimidazoleSMILES: CS(=O)(=O)C1=NC2=CC(=C(C=C2N1)Cl)OC3=C(C(=CC=C3)Cl)ClInChIKey: ZEIHWBIRYIXBSV-UHFFFAOYSA-NInChI: InChI=1S/C14H9Cl3N2O3S/c1-23(20,21)14-18-9-5-8(16)12(6-10(9)19-14)22-11-4-2-3-7(15)13(11)17/h2-6H,1H3,(H,18,19)
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7-Bromo-5-fluoro-1H-benzo[d]imidazoleCas Number: 1245642-98-1 Compound CID: 52987862Formula: C7H4N2FBr Molecular Weight: 215.02IUPAC Name: 4-bromo-6-fluoro-1H-benzimidazoleSMILES: C1=C(C=C(C2=C1NC=N2)Br)FInChIKey: MGODHAPVAQOGMN-UHFFFAOYSA-NInChI: InChI=1S/C7H4BrFN2/c8-5-1-4(9)2-6-7(5)11-3-10-6/h1-3H,(H,10,11)
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5-(tert-Butyl)-1H-benzo[d]imidazoleCas Number: 110534-15-1 Compound CID: 20316164Formula: C11H14N2 Molecular Weight: 174.24IUPAC Name: 6-tert-butyl-1H-benzimidazoleSMILES: CC(C)(C)C1=CC2=C(C=C1)N=CN2InChIKey: DWAWUJTUMDEWBR-UHFFFAOYSA-NInChI: InChI=1S/C11H14N2/c1-11(2,3)8-4-5-9-10(6-8)13-7-12-9/h4-7H,1-3H3,(H,12,13)
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Lansoprazole sodiumCas Number: 226904-00-3Formula: C16H13F3N3NaO2S Molecular Weight: 391.34SMILES: CC1=C(C=CN=C1CS(=O)C2=NC3=CC=CC=C3[N-]2)OCC(F)(F)F.[Na+]InChIKey: OTGPYEHFRKGRIZ-UHFFFAOYSA-NInChI: InChI=1S/C16H13F3N3O2S.Na/c1-10-13(20-7-6-14(10)24-9-16(17,18)19)8-25(23)15-21-11-4-2-3-5-12(11)22-15;/h2-7H,8-9H2,1H3;/q-1;+1
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2，2-dimethyl-2H-1，3-benzimidazolediium-1，3-diolateCas Number: 31980-12-8 Compound CID: 601160Formula: C9H10N2O2 Molecular Weight: 178.19IUPAC Name: 2,2-dimethyl-3-oxidobenzimidazol-1-ium 1-oxideSMILES: CC1(N(C2=CC=CC=C2[N+]1=O)[O-])CInChIKey: XQYKDQBVUBUIOU-UHFFFAOYSA-NInChI: InChI=1S/C9H10N2O2/c1-9(2)10(12)7-5-3-4-6-8(7)11(9)13/h3-6H,1-2H3
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2，2'-(1，2-Phenylene)bis(1H-benzimidazole)Cas Number: 4506-61-0 Compound CID: 828108Formula: C20H14N4 Molecular Weight: 310.4IUPAC Name: 2-[2-(1H-benzimidazol-2-yl)phenyl]-1H-benzimidazoleSMILES: C1=CC=C(C(=C1)C2=NC3=CC=CC=C3N2)C4=NC5=CC=CC=C5N4InChIKey: NQVCKXMOMGRVES-UHFFFAOYSA-NInChI: InChI=1S/C20H14N4/c1-2-8-14(20-23-17-11-5-6-12-18(17)24-20)13(7-1)19-21-15-9-3-4-10-16(15)22-19/h1-12H,(H,21,22)(H,23,24)
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2-[[(4-Methoxy-3-methyl-2-pyridinyl)methyl]thio]-6-(1H-pyrrol-1-yl)-1H-benzimidazoleCas Number: 172152-35-1Formula: C19H18N4OS Molecular Weight: 350.4374SMILES: CC1=C(C=CN=C1CSC2=NC3=C(N2)C=C(C=C3)N4C=CC=C4)OCInChIKey: TZNQIYXOVOTIKQ-UHFFFAOYSA-NInChI: InChI=1S/C19H18N4OS/c1-13-17(20-8-7-18(13)24-2)12-25-19-21-15-6-5-14(11-16(15)22-19)23-9-3-4-10-23/h3-11H,12H2,1-2H3,(H,21,22)
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2-Amino-5-n-propylsulfonylbenzimidazoleCas Number: 80983-34-2 Compound CID: 88125Formula: C10H13N3O2S Molecular Weight: 239.3IUPAC Name: 6-propylsulfonyl-1H-benzimidazol-2-amineSMILES: CCCS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)NInChIKey: WTPBIYSMFKUQKY-UHFFFAOYSA-NInChI: InChI=1S/C10H13N3O2S/c1-2-5-16(14,15)7-3-4-8-9(6-7)13-10(11)12-8/h3-4,6H,2,5H2,1H3,(H3,11,12,13)
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2-Amino-6-methoxy-1-methylbenzimidazoleCas Number: 945023-35-8 Compound CID: 69448957Formula: C9H11N3O Molecular Weight: 177.2IUPAC Name: 6-methoxy-1-methylbenzimidazol-2-amineSMILES: CN1C2=C(C=CC(=C2)OC)N=C1NInChIKey: ZPMOYIRMYULFEH-UHFFFAOYSA-NInChI: InChI=1S/C9H11N3O/c1-12-8-5-6(13-2)3-4-7(8)11-9(12)10/h3-5H,1-2H3,(H2,10,11)
