(2S)-N1-methyl-4-methylsulfanyl-N1-phenyl-butane-1,2-diamine

Systemtic Name: (2S)-N1-methyl-4-methylsulfanyl-N1-phenyl-butane-1,2-diamine Openeye Name: (2S)-N1-methyl-4-methylsulfanyl-N1-phenyl-butane-1,2-diamine CAS Name: (2S)-N1-methyl-4-(methylthio)-N1-phenylbutane-1,2-diamine IUPAC Name: (2S)-1-N-methyl-4-methylsulfanyl-1-N-phenylbutane-1,2-diamine Traditional Name: [(2S)-2-amino-4-(methylthio)butyl]-methyl-phenyl-amine Formula: C12H20N2S MolecularWeight: 224.3656

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(CCSC)N)C1=CC=CC=C1

Isomeric SMILES

CN(C[C@H](CCSC)N)C1=CC=CC=C1

InChI

InChI=1S/C12H20N2S/c1-14(10-11(13)8-9-15-2)12-6-4-3-5-7-12/h3-7,11H,8-10,13H2,1-2H3/t11-/m0/s1