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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NCC2=CC=C(C=C2)SC)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NCC2=CC=C(C=C2)SC)Cl)OC

InChI

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