N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-2-methylsulfanyl-aniline

Systemtic Name: N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-2-methylsulfanyl-aniline Openeye Name: N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-2-methylsulfanyl-aniline CAS Name: N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-2-(methylthio)aniline IUPAC Name: N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-2-methylsulfanylaniline Traditional Name: (7-methoxy-1,3-benzodioxol-5-yl)methyl-[2-(methylthio)phenyl]amine Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)CNC3=CC=CC=C3SC

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)CNC3=CC=CC=C3SC

InChI

InChI=1S/C16H17NO3S/c1-18-13-7-11(8-14-16(13)20-10-19-14)9-17-12-5-3-4-6-15(12)21-2/h3-8,17H,9-10H2,1-2H3