(6-bromanyl-1,3-benzodioxol-5-yl)methyl 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 2-methylsulfanylpyridine-3-carboxylate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C15H12BrNO4S MolecularWeight: 382.22908

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)OCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)OCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C15H12BrNO4S/c1-22-14-10(3-2-4-17-14)15(18)19-7-9-5-12-13(6-11(9)16)21-8-20-12/h2-6H,7-8H2,1H3