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

Systemtic Name: N-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]-2-methylsulfanyl-aniline Openeye Name: N-[(5-bromo-2,4-dimethoxy-phenyl)methyl]-2-methylsulfanyl-aniline CAS Name: N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-2-(methylthio)aniline IUPAC Name: N-[(5-bromo-2,4-dimethoxyphenyl)methyl]-2-methylsulfanylaniline Traditional Name: (5-bromo-2,4-dimethoxy-benzyl)-[2-(methylthio)phenyl]amine Formula: C16H18BrNO2S MolecularWeight: 368.28862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC2=CC=CC=C2SC)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC2=CC=CC=C2SC)Br)OC

InChI

InChI=1S/C16H18BrNO2S/c1-19-14-9-15(20-2)12(17)8-11(14)10-18-13-6-4-5-7-16(13)21-3/h4-9,18H,10H2,1-3H3