2-chloranyl-4,5-dimethoxy-N-[(4-methylsulfanylphenyl)methyl]aniline

Systemtic Name: 2-chloranyl-4,5-dimethoxy-N-[(4-methylsulfanylphenyl)methyl]aniline Openeye Name: 2-chloro-4,5-dimethoxy-N-[(4-methylsulfanylphenyl)methyl]aniline CAS Name: 2-chloro-4,5-dimethoxy-N-[[4-(methylthio)phenyl]methyl]aniline IUPAC Name: 2-chloro-4,5-dimethoxy-N-[(4-methylsulfanylphenyl)methyl]aniline Traditional Name: (2-chloro-4,5-dimethoxy-phenyl)-[4-(methylthio)benzyl]amine Formula: C16H18ClNO2S MolecularWeight: 323.83762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NCC2=CC=C(C=C2)SC)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)NCC2=CC=C(C=C2)SC)Cl)OC

InChI

InChI=1S/C16H18ClNO2S/c1-19-15-8-13(17)14(9-16(15)20-2)18-10-11-4-6-12(21-3)7-5-11/h4-9,18H,10H2,1-3H3