2-(4-chlorophenyl)sulfanyl-N-[4-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]phenyl]ethanamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-[4-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]phenyl]ethanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-[4-[4-(4-methoxybenzoyl)piperazin-1-yl]phenyl]acetamide CAS Name: 2-[(4-chlorophenyl)thio]-N-[4-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperazinyl]phenyl]acetamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-[4-[4-(4-methoxybenzoyl)piperazin-1-yl]phenyl]acetamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-[4-(4-p-anisoylpiperazino)phenyl]acetamide Formula: C26H26ClN3O3S MolecularWeight: 496.02094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H26ClN3O3S/c1-33-23-10-2-19(3-11-23)26(32)30-16-14-29(15-17-30)22-8-6-21(7-9-22)28-25(31)18-34-24-12-4-20(27)5-13-24/h2-13H,14-18H2,1H3,(H,28,31)