N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-2-phenylsulfanyl-propanamide

Systemtic Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-2-phenylsulfanyl-propanamide Openeye Name: N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]-2-phenylsulfanyl-propanamide CAS Name: N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-2-(phenylthio)propanamide IUPAC Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-2-phenylsulfanylpropanamide Traditional Name: N-[3-[4-(m-tolyl)piperazino]propyl]-2-(phenylthio)propionamide Formula: C23H31N3OS MolecularWeight: 397.57674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C(C)SC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C(C)SC3=CC=CC=C3

InChI

InChI=1S/C23H31N3OS/c1-19-8-6-9-21(18-19)26-16-14-25(15-17-26)13-7-12-24-23(27)20(2)28-22-10-4-3-5-11-22/h3-6,8-11,18,20H,7,12-17H2,1-2H3,(H,24,27)