N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]acetamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-(4-phenyl-1-piperazinyl)ethyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]acetamide Traditional Name: 2-(benzylthio)-N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazino)ethyl]acetamide Formula: C29H36N4OS MolecularWeight: 488.68734

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)CSCC2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNC(=O)CSCC2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C29H36N4OS/c1-31(2)26-15-13-25(14-16-26)28(21-30-29(34)23-35-22-24-9-5-3-6-10-24)33-19-17-32(18-20-33)27-11-7-4-8-12-27/h3-16,28H,17-23H2,1-2H3,(H,30,34)