2-(4-methylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)-N-(phenylmethyl)ethanamine

Systemtic Name: 2-(4-methylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)-N-(phenylmethyl)ethanamine Openeye Name: N-benzyl-2-(3-methylsulfanylpiperazin-1-yl)-2-(p-tolyl)ethanamine CAS Name: 2-(4-methylphenyl)-2-[3-(methylthio)-1-piperazinyl]-N-(phenylmethyl)ethanamine IUPAC Name: N-benzyl-2-(4-methylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)ethanamine Traditional Name: benzyl-[2-[3-(methylthio)piperazino]-2-(p-tolyl)ethyl]amine Formula: C21H29N3S MolecularWeight: 355.54006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNCC2=CC=CC=C2)N3CCNC(C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)C(CNCC2=CC=CC=C2)N3CCNC(C3)SC

InChI

InChI=1S/C21H29N3S/c1-17-8-10-19(11-9-17)20(24-13-12-23-21(16-24)25-2)15-22-14-18-6-4-3-5-7-18/h3-11,20-23H,12-16H2,1-2H3