2-[4-[2-(2-methylpropyl)-4-methylsulfanyl-phenyl]piperazin-2-yl]phenol

Systemtic Name: 2-[4-[2-(2-methylpropyl)-4-methylsulfanyl-phenyl]piperazin-2-yl]phenol Openeye Name: 2-[4-(2-isobutyl-4-methylsulfanyl-phenyl)piperazin-2-yl]phenol CAS Name: 2-[4-[2-(2-methylpropyl)-4-(methylthio)phenyl]-2-piperazinyl]phenol IUPAC Name: 2-[4-[2-(2-methylpropyl)-4-methylsulfanylphenyl]piperazin-2-yl]phenol Traditional Name: 2-[4-[2-isobutyl-4-(methylthio)phenyl]piperazin-2-yl]phenol Formula: C21H28N2OS MolecularWeight: 356.52482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2OS/c1-15(2)12-16-13-17(25-3)8-9-20(16)23-11-10-22-19(14-23)18-6-4-5-7-21(18)24/h4-9,13,15,19,22,24H,10-12,14H2,1-3H3