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

Systemtic Name: N-[(7-bromanyl-1,3-benzodioxol-5-yl)methyl]-2-methylsulfanyl-aniline Openeye Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-2-methylsulfanyl-aniline CAS Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-2-(methylthio)aniline IUPAC Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-2-methylsulfanylaniline Traditional Name: (7-bromo-1,3-benzodioxol-5-yl)methyl-[2-(methylthio)phenyl]amine Formula: C15H14BrNO2S MolecularWeight: 352.24616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NCC2=CC3=C(C(=C2)Br)OCO3

Isomeric SMILES

CSC1=CC=CC=C1NCC2=CC3=C(C(=C2)Br)OCO3

InChI

InChI=1S/C15H14BrNO2S/c1-20-14-5-3-2-4-12(14)17-8-10-6-11(16)15-13(7-10)18-9-19-15/h2-7,17H,8-9H2,1H3