1-(4-chlorophenyl)-2-[5-methoxy-1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-ethanone hydrobromide

Systemtic Name: 1-(4-chlorophenyl)-2-[5-methoxy-1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-ethanone hydrobromide Openeye Name: 2-(1-benzyl-5-methoxy-benzimidazol-2-yl)sulfanyl-1-(4-chlorophenyl)ethanone hydrobromide CAS Name: 1-(4-chlorophenyl)-2-[[5-methoxy-1-(phenylmethyl)-2-benzimidazolyl]thio]ethanone hydrobromide IUPAC Name: 2-(1-benzyl-5-methoxybenzimidazol-2-yl)sulfanyl-1-(4-chlorophenyl)ethanone hydrobromide Traditional Name: 2-[(1-benzyl-5-methoxy-benzimidazol-2-yl)thio]-1-(4-chlorophenyl)ethanone hydrobromide Formula: C23H20BrClN2O2S MolecularWeight: 503.8391

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=N2)SCC(=O)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4.Br

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=N2)SCC(=O)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4.Br

InChI

InChI=1S/C23H19ClN2O2S.BrH/c1-28-19-11-12-21-20(13-19)25-23(26(21)14-16-5-3-2-4-6-16)29-15-22(27)17-7-9-18(24)10-8-17;/h2-13H,14-15H2,1H3;1H