1-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-2-(3-methylbutylsulfanyl)benzimidazole

Systemtic Name: 1-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-2-(3-methylbutylsulfanyl)benzimidazole Openeye Name: 1-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-2-isopentylsulfanyl-benzimidazole CAS Name: 1-[[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]methyl]-2-(3-methylbutylthio)benzimidazole IUPAC Name: 1-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-2-(3-methylbutylsulfanyl)benzimidazole Traditional Name: 1-[[4-(4-chlorophenyl)sulfonylpiperazino]methyl]-2-(isoamylthio)benzimidazole Formula: C23H29ClN4O2S2 MolecularWeight: 493.08496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NC2=CC=CC=C2N1CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)CCSC1=NC2=CC=CC=C2N1CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H29ClN4O2S2/c1-18(2)11-16-31-23-25-21-5-3-4-6-22(21)28(23)17-26-12-14-27(15-13-26)32(29,30)20-9-7-19(24)8-10-20/h3-10,18H,11-17H2,1-2H3