2-(4-methylsulfanylphenyl)-1-[3-(4-phenylpiperazin-1-yl)piperidin-1-yl]ethanone

Systemtic Name: 2-(4-methylsulfanylphenyl)-1-[3-(4-phenylpiperazin-1-yl)piperidin-1-yl]ethanone Openeye Name: 2-(4-methylsulfanylphenyl)-1-[3-(4-phenylpiperazin-1-yl)-1-piperidyl]ethanone CAS Name: 2-[4-(methylthio)phenyl]-1-[3-(4-phenyl-1-piperazinyl)-1-piperidinyl]ethanone IUPAC Name: 2-(4-methylsulfanylphenyl)-1-[3-(4-phenylpiperazin-1-yl)piperidin-1-yl]ethanone Traditional Name: 2-[4-(methylthio)phenyl]-1-[3-(4-phenylpiperazino)piperidino]ethanone Formula: C24H31N3OS MolecularWeight: 409.58744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3OS/c1-29-23-11-9-20(10-12-23)18-24(28)27-13-5-8-22(19-27)26-16-14-25(15-17-26)21-6-3-2-4-7-21/h2-4,6-7,9-12,22H,5,8,13-19H2,1H3