N-methyl-N'-[(4-methylsulfanylphenyl)methyl]propane-1,3-diamine hydrochloride

Systemtic Name: N-methyl-N'-[(4-methylsulfanylphenyl)methyl]propane-1,3-diamine hydrochloride Openeye Name: N-methyl-N'-[(4-methylsulfanylphenyl)methyl]propane-1,3-diamine hydrochloride CAS Name: N-methyl-N'-[[4-(methylthio)phenyl]methyl]propane-1,3-diamine hydrochloride IUPAC Name: N-methyl-N'-[(4-methylsulfanylphenyl)methyl]propane-1,3-diamine hydrochloride Traditional Name: methyl-[3-[[4-(methylthio)benzyl]amino]propyl]amine hydrochloride Formula: C12H21ClN2S MolecularWeight: 260.82654

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCNCC1=CC=C(C=C1)SC.Cl

Isomeric SMILES

CNCCCNCC1=CC=C(C=C1)SC.Cl

InChI

InChI=1S/C12H20N2S.ClH/c1-13-8-3-9-14-10-11-4-6-12(15-2)7-5-11;/h4-7,13-14H,3,8-10H2,1-2H3;1H