2-[[2-(4-methylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)ethyl]amino]phenol

Systemtic Name: 2-[[2-(4-methylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)ethyl]amino]phenol Openeye Name: 2-[[2-(3-methylsulfanylpiperazin-1-yl)-2-(p-tolyl)ethyl]amino]phenol CAS Name: 2-[[2-(4-methylphenyl)-2-[3-(methylthio)-1-piperazinyl]ethyl]amino]phenol IUPAC Name: 2-[[2-(4-methylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)ethyl]amino]phenol Traditional Name: 2-[[2-[3-(methylthio)piperazino]-2-(p-tolyl)ethyl]amino]phenol Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNC2=CC=CC=C2O)N3CCNC(C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)C(CNC2=CC=CC=C2O)N3CCNC(C3)SC

InChI

InChI=1S/C20H27N3OS/c1-15-7-9-16(10-8-15)18(23-12-11-21-20(14-23)25-2)13-22-17-5-3-4-6-19(17)24/h3-10,18,20-22,24H,11-14H2,1-2H3