2-[4-[1-(4-methylphenyl)-2-(methylsulfanylamino)ethyl]piperazin-2-yl]phenol

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNSC)N2CCNC(C2)C3=CC=CC=C3O

Isomeric SMILES

CC1=CC=C(C=C1)C(CNSC)N2CCNC(C2)C3=CC=CC=C3O

InChI

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