3-acetamido-N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]-4-(4-methylphenyl)sulfanyl-benzamide

Systemtic Name: 3-acetamido-N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]-4-(4-methylphenyl)sulfanyl-benzamide Openeye Name: 3-acetamido-N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]-4-(p-tolylsulfanyl)benzamide CAS Name: 3-acetamido-N-[2-[4-(3-chlorophenyl)-1-piperazinyl]ethyl]-4-[(4-methylphenyl)thio]benzamide IUPAC Name: 3-acetamido-N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]-4-(4-methylphenyl)sulfanylbenzamide Traditional Name: 3-acetamido-N-[2-[4-(3-chlorophenyl)piperazino]ethyl]-4-(p-tolylthio)benzamide Formula: C28H31ClN4O2S MolecularWeight: 523.08934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NCCN3CCN(CC3)C4=CC(=CC=C4)Cl)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NCCN3CCN(CC3)C4=CC(=CC=C4)Cl)NC(=O)C

InChI

InChI=1S/C28H31ClN4O2S/c1-20-6-9-25(10-7-20)36-27-11-8-22(18-26(27)31-21(2)34)28(35)30-12-13-32-14-16-33(17-15-32)24-5-3-4-23(29)19-24/h3-11,18-19H,12-17H2,1-2H3,(H,30,35)(H,31,34)