[4-[(4-methylphenyl)sulfanylmethyl]phenyl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [4-[(4-methylphenyl)sulfanylmethyl]phenyl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: (4-phenylpiperazin-1-yl)-[4-(p-tolylsulfanylmethyl)phenyl]methanone CAS Name: [4-[[(4-methylphenyl)thio]methyl]phenyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [4-[(4-methylphenyl)sulfanylmethyl]phenyl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: (4-phenylpiperazino)-[4-[(p-tolylthio)methyl]phenyl]methanone Formula: C25H26N2OS MolecularWeight: 402.55174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2OS/c1-20-7-13-24(14-8-20)29-19-21-9-11-22(12-10-21)25(28)27-17-15-26(16-18-27)23-5-3-2-4-6-23/h2-14H,15-19H2,1H3