2-(3-methoxypiperazin-1-yl)-2-[4-(2-methylpropyl)phenyl]-N-methylsulfanyl-ethanamine

Systemtic Name: 2-(3-methoxypiperazin-1-yl)-2-[4-(2-methylpropyl)phenyl]-N-methylsulfanyl-ethanamine Openeye Name: 2-(4-isobutylphenyl)-2-(3-methoxypiperazin-1-yl)-N-methylsulfanyl-ethanamine CAS Name: N-[2-(3-methoxy-1-piperazinyl)-2-[4-(2-methylpropyl)phenyl]ethyl]methanesulfenamide IUPAC Name: 2-(3-methoxypiperazin-1-yl)-2-[4-(2-methylpropyl)phenyl]-N-methylsulfanylethanamine Traditional Name: [2-(4-isobutylphenyl)-2-(3-methoxypiperazino)ethyl]-(methylthio)amine Formula: C18H31N3OS MolecularWeight: 337.52324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H31N3OS/c1-14(2)11-15-5-7-16(8-6-15)17(12-20-23-4)21-10-9-19-18(13-21)22-3/h5-8,14,17-20H,9-13H2,1-4H3