2-(4-methylphenyl)sulfanyl-N-[2-(4-phenylpiperazin-1-yl)carbonylphenyl]ethanamide

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-[2-(4-phenylpiperazin-1-yl)carbonylphenyl]ethanamide Openeye Name: N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]-2-(p-tolylsulfanyl)acetamide CAS Name: 2-[(4-methylphenyl)thio]-N-[2-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]acetamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]acetamide Traditional Name: N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]-2-(p-tolylthio)acetamide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=CC=CC=C2C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=CC=CC=C2C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O2S/c1-20-11-13-22(14-12-20)32-19-25(30)27-24-10-6-5-9-23(24)26(31)29-17-15-28(16-18-29)21-7-3-2-4-8-21/h2-14H,15-19H2,1H3,(H,27,30)