N-[(3-chloranyl-4,5-dimethoxy-phenyl)methyl]-2-methylsulfanyl-aniline

Systemtic Name: N-[(3-chloranyl-4,5-dimethoxy-phenyl)methyl]-2-methylsulfanyl-aniline Openeye Name: N-[(3-chloro-4,5-dimethoxy-phenyl)methyl]-2-methylsulfanyl-aniline CAS Name: N-[(3-chloro-4,5-dimethoxyphenyl)methyl]-2-(methylthio)aniline IUPAC Name: N-[(3-chloro-4,5-dimethoxyphenyl)methyl]-2-methylsulfanylaniline Traditional Name: (3-chloro-4,5-dimethoxy-benzyl)-[2-(methylthio)phenyl]amine Formula: C16H18ClNO2S MolecularWeight: 323.83762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2=CC=CC=C2SC)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2=CC=CC=C2SC)Cl)OC

InChI

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