2-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1-(phenylmethyl)benzimidazole

Systemtic Name: 2-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1-(phenylmethyl)benzimidazole Openeye Name: 1-benzyl-2-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]benzimidazole CAS Name: 2-[[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]methyl]-1-(phenylmethyl)benzimidazole IUPAC Name: 1-benzyl-2-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]benzimidazole Traditional Name: 1-benzyl-2-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]methyl]benzimidazole Formula: C27H30N4O4S MolecularWeight: 506.6165

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3CC5=CC=CC=C5)OC

InChI

InChI=1S/C27H30N4O4S/c1-34-25-13-12-22(18-26(25)35-2)36(32,33)30-16-14-29(15-17-30)20-27-28-23-10-6-7-11-24(23)31(27)19-21-8-4-3-5-9-21/h3-13,18H,14-17,19-20H2,1-2H3