N-[4-[4-[2-(2-methylphenyl)ethanoyl]piperazin-1-yl]phenyl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[4-[4-[2-(2-methylphenyl)ethanoyl]piperazin-1-yl]phenyl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[4-[4-[2-(o-tolyl)acetyl]piperazin-1-yl]phenyl]-2-phenylsulfanyl-acetamide CAS Name: N-[4-[4-[2-(2-methylphenyl)-1-oxoethyl]-1-piperazinyl]phenyl]-2-(phenylthio)acetamide IUPAC Name: N-[4-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]phenyl]-2-phenylsulfanylacetamide Traditional Name: N-[4-[4-[2-(o-tolyl)acetyl]piperazino]phenyl]-2-(phenylthio)acetamide Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)CSC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CC(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O2S/c1-21-7-5-6-8-22(21)19-27(32)30-17-15-29(16-18-30)24-13-11-23(12-14-24)28-26(31)20-33-25-9-3-2-4-10-25/h2-14H,15-20H2,1H3,(H,28,31)