(3S)-N-(3-methylsulfanylphenyl)-3-(4-phenylpiperazin-1-yl)piperidine-1-carboxamide

Systemtic Name: (3S)-N-(3-methylsulfanylphenyl)-3-(4-phenylpiperazin-1-yl)piperidine-1-carboxamide Openeye Name: (3S)-N-(3-methylsulfanylphenyl)-3-(4-phenylpiperazin-1-yl)piperidine-1-carboxamide CAS Name: (3S)-N-[3-(methylthio)phenyl]-3-(4-phenyl-1-piperazinyl)-1-piperidinecarboxamide IUPAC Name: (3S)-N-(3-methylsulfanylphenyl)-3-(4-phenylpiperazin-1-yl)piperidine-1-carboxamide Traditional Name: (3S)-N-[3-(methylthio)phenyl]-3-(4-phenylpiperazino)piperidine-1-carboxamide Formula: C23H30N4OS MolecularWeight: 410.5755

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)N2CCCC(C2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)N2CCC[C@@H](C2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H30N4OS/c1-29-22-11-5-7-19(17-22)24-23(28)27-12-6-10-21(18-27)26-15-13-25(14-16-26)20-8-3-2-4-9-20/h2-5,7-9,11,17,21H,6,10,12-16,18H2,1H3,(H,24,28)/t21-/m0/s1