4-[1-[4-(2-methylpropyl)phenyl]-2-(methylsulfanylamino)ethyl]piperazin-2-ol

Systemtic Name: 4-[1-[4-(2-methylpropyl)phenyl]-2-(methylsulfanylamino)ethyl]piperazin-2-ol Openeye Name: 4-[1-(4-isobutylphenyl)-2-(methylsulfanylamino)ethyl]piperazin-2-ol CAS Name: N-[2-(3-hydroxy-1-piperazinyl)-2-[4-(2-methylpropyl)phenyl]ethyl]methanesulfenamide IUPAC Name: 4-[1-[4-(2-methylpropyl)phenyl]-2-(methylsulfanylamino)ethyl]piperazin-2-ol Traditional Name: 4-[1-(4-isobutylphenyl)-2-[(methylthio)amino]ethyl]piperazin-2-ol Formula: C17H29N3OS MolecularWeight: 323.49666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(CNSC)N2CCNC(C2)O

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(CNSC)N2CCNC(C2)O

InChI

InChI=1S/C17H29N3OS/c1-13(2)10-14-4-6-15(7-5-14)16(11-19-22-3)20-9-8-18-17(21)12-20/h4-7,13,16-19,21H,8-12H2,1-3H3