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

Systemtic Name: 2-[(4-bromanyl-2,5-dimethoxy-phenyl)methylsulfanyl]aniline Openeye Name: 2-[(4-bromo-2,5-dimethoxy-phenyl)methylsulfanyl]aniline CAS Name: 2-[(4-bromo-2,5-dimethoxyphenyl)methylthio]aniline IUPAC Name: 2-[(4-bromo-2,5-dimethoxyphenyl)methylsulfanyl]aniline Traditional Name: [2-[(4-bromo-2,5-dimethoxy-benzyl)thio]phenyl]amine Formula: C15H16BrNO2S MolecularWeight: 354.26204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CSC2=CC=CC=C2N)OC)Br

Isomeric SMILES

COC1=CC(=C(C=C1CSC2=CC=CC=C2N)OC)Br

InChI

InChI=1S/C15H16BrNO2S/c1-18-13-8-11(16)14(19-2)7-10(13)9-20-15-6-4-3-5-12(15)17/h3-8H,9,17H2,1-2H3