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

Systemtic Name: 4-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]aniline Openeye Name: 4-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]aniline CAS Name: 4-[(4,5-dimethoxy-2-methylphenyl)methylthio]aniline IUPAC Name: 4-[(4,5-dimethoxy-2-methylphenyl)methylsulfanyl]aniline Traditional Name: [4-[(4,5-dimethoxy-2-methyl-benzyl)thio]phenyl]amine Formula: C16H19NO2S MolecularWeight: 289.39256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CSC2=CC=C(C=C2)N)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CSC2=CC=C(C=C2)N)OC)OC

InChI

InChI=1S/C16H19NO2S/c1-11-8-15(18-2)16(19-3)9-12(11)10-20-14-6-4-13(17)5-7-14/h4-9H,10,17H2,1-3H3