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

Systemtic Name: N-methyl-1-(4-methylsulfanylphenyl)-N-(pyridin-4-ylmethyl)ethane-1,2-diamine Openeye Name: N-methyl-1-(4-methylsulfanylphenyl)-N-(4-pyridylmethyl)ethane-1,2-diamine CAS Name: N-methyl-1-[4-(methylthio)phenyl]-N-(pyridin-4-ylmethyl)ethane-1,2-diamine IUPAC Name: N-methyl-1-(4-methylsulfanylphenyl)-N-(pyridin-4-ylmethyl)ethane-1,2-diamine Traditional Name: [2-amino-1-[4-(methylthio)phenyl]ethyl]-methyl-(4-pyridylmethyl)amine Formula: C16H21N3S MolecularWeight: 287.42304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=NC=C1)C(CN)C2=CC=C(C=C2)SC

Isomeric SMILES

CN(CC1=CC=NC=C1)C(CN)C2=CC=C(C=C2)SC

InChI

InChI=1S/C16H21N3S/c1-19(12-13-7-9-18-10-8-13)16(11-17)14-3-5-15(20-2)6-4-14/h3-10,16H,11-12,17H2,1-2H3