3-[(2-methylphenyl)methyl]-5-(2-methylsulfanylethyl)-1-phenyl-piperazin-2-one

Systemtic Name: 3-[(2-methylphenyl)methyl]-5-(2-methylsulfanylethyl)-1-phenyl-piperazin-2-one Openeye Name: 5-(2-methylsulfanylethyl)-3-(o-tolylmethyl)-1-phenyl-piperazin-2-one CAS Name: 3-[(2-methylphenyl)methyl]-5-[2-(methylthio)ethyl]-1-phenyl-2-piperazinone IUPAC Name: 3-[(2-methylphenyl)methyl]-5-(2-methylsulfanylethyl)-1-phenylpiperazin-2-one Traditional Name: 3-(2-methylbenzyl)-5-[2-(methylthio)ethyl]-1-phenyl-piperazin-2-one Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2C(=O)N(CC(N2)CCSC)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CC2C(=O)N(CC(N2)CCSC)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2OS/c1-16-8-6-7-9-17(16)14-20-21(24)23(19-10-4-3-5-11-19)15-18(22-20)12-13-25-2/h3-11,18,20,22H,12-15H2,1-2H3