(2S)-1-[4-(3-methylphenyl)piperazin-1-yl]-4-methylsulfanyl-butan-2-amine

Systemtic Name: (2S)-1-[4-(3-methylphenyl)piperazin-1-yl]-4-methylsulfanyl-butan-2-amine Openeye Name: (2S)-4-methylsulfanyl-1-[4-(m-tolyl)piperazin-1-yl]butan-2-amine CAS Name: (2S)-1-[4-(3-methylphenyl)-1-piperazinyl]-4-(methylthio)-2-butanamine IUPAC Name: (2S)-1-[4-(3-methylphenyl)piperazin-1-yl]-4-methylsulfanylbutan-2-amine Traditional Name: [(1S)-3-(methylthio)-1-[[4-(m-tolyl)piperazino]methyl]propyl]amine Formula: C16H27N3S MolecularWeight: 293.47068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CC(CCSC)N

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C[C@H](CCSC)N

InChI

InChI=1S/C16H27N3S/c1-14-4-3-5-16(12-14)19-9-7-18(8-10-19)13-15(17)6-11-20-2/h3-5,12,15H,6-11,13,17H2,1-2H3/t15-/m0/s1