2-(1H-benzimidazol-2-ylsulfanyl)-1-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]ethanone CAS Name: 2-(1H-benzimidazol-2-ylthio)-1-[4-[(3,4,5-trimethoxyphenyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-1-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-(1H-benzimidazol-2-ylthio)-1-[4-(3,4,5-trimethoxybenzyl)piperazino]ethanone Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CN2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CN2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C23H28N4O4S/c1-29-19-12-16(13-20(30-2)22(19)31-3)14-26-8-10-27(11-9-26)21(28)15-32-23-24-17-6-4-5-7-18(17)25-23/h4-7,12-13H,8-11,14-15H2,1-3H3,(H,24,25)