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

Systemtic Name: (2S)-N1-methyl-4-methylsulfanyl-N1-(2-pyridin-4-ylethyl)butane-1,2-diamine Openeye Name: (2S)-N1-methyl-4-methylsulfanyl-N1-[2-(4-pyridyl)ethyl]butane-1,2-diamine CAS Name: (2S)-N1-methyl-4-(methylthio)-N1-(2-pyridin-4-ylethyl)butane-1,2-diamine IUPAC Name: (2S)-1-N-methyl-4-methylsulfanyl-1-N-(2-pyridin-4-ylethyl)butane-1,2-diamine Traditional Name: [(2S)-2-amino-4-(methylthio)butyl]-methyl-[2-(4-pyridyl)ethyl]amine Formula: C13H23N3S MolecularWeight: 253.40682

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=NC=C1)CC(CCSC)N

Isomeric SMILES

CN(CCC1=CC=NC=C1)C[C@H](CCSC)N

InChI

InChI=1S/C13H23N3S/c1-16(11-13(14)6-10-17-2)9-5-12-3-7-15-8-4-12/h3-4,7-8,13H,5-6,9-11,14H2,1-2H3/t13-/m0/s1