2-[4-(2-methylpropyl)phenyl]-2-(3-methylsulfanylpiperazin-1-yl)-N-(phenylmethyl)ethanamine

Systemtic Name: 2-[4-(2-methylpropyl)phenyl]-2-(3-methylsulfanylpiperazin-1-yl)-N-(phenylmethyl)ethanamine Openeye Name: N-benzyl-2-(4-isobutylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)ethanamine CAS Name: 2-[4-(2-methylpropyl)phenyl]-2-[3-(methylthio)-1-piperazinyl]-N-(phenylmethyl)ethanamine IUPAC Name: N-benzyl-2-[4-(2-methylpropyl)phenyl]-2-(3-methylsulfanylpiperazin-1-yl)ethanamine Traditional Name: benzyl-[2-(4-isobutylphenyl)-2-[3-(methylthio)piperazino]ethyl]amine Formula: C24H35N3S MolecularWeight: 397.6198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(CNCC2=CC=CC=C2)N3CCNC(C3)SC

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(CNCC2=CC=CC=C2)N3CCNC(C3)SC

InChI

InChI=1S/C24H35N3S/c1-19(2)15-20-9-11-22(12-10-20)23(27-14-13-26-24(18-27)28-3)17-25-16-21-7-5-4-6-8-21/h4-12,19,23-26H,13-18H2,1-3H3