N-methyl-1-(4-methylsulfanylphenyl)-N-propyl-ethane-1,2-diamine

Systemtic Name: N-methyl-1-(4-methylsulfanylphenyl)-N-propyl-ethane-1,2-diamine Openeye Name: N-methyl-1-(4-methylsulfanylphenyl)-N-propyl-ethane-1,2-diamine CAS Name: N-methyl-1-[4-(methylthio)phenyl]-N-propylethane-1,2-diamine IUPAC Name: N-methyl-1-(4-methylsulfanylphenyl)-N-propylethane-1,2-diamine Traditional Name: [2-amino-1-[4-(methylthio)phenyl]ethyl]-methyl-propyl-amine Formula: C13H22N2S MolecularWeight: 238.39218

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C(CN)C1=CC=C(C=C1)SC

Isomeric SMILES

CCCN(C)C(CN)C1=CC=C(C=C1)SC

InChI

InChI=1S/C13H22N2S/c1-4-9-15(2)13(10-14)11-5-7-12(16-3)8-6-11/h5-8,13H,4,9-10,14H2,1-3H3