methyl 5-bromanyl-2-[(2-methylsulfanylpyridin-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 5-bromanyl-2-[(2-methylsulfanylpyridin-3-yl)carbonylamino]benzoate Openeye Name: methyl 5-bromo-2-[(2-methylsulfanylpyridine-3-carbonyl)amino]benzoate CAS Name: 5-bromo-2-[[[2-(methylthio)-3-pyridinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[(2-methylsulfanylpyridine-3-carbonyl)amino]benzoate Traditional Name: 5-bromo-2-[[2-(methylthio)nicotinoyl]amino]benzoic acid methyl ester Formula: C15H13BrN2O3S MolecularWeight: 381.24432

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)NC(=O)C2=C(N=CC=C2)SC

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)NC(=O)C2=C(N=CC=C2)SC

InChI

InChI=1S/C15H13BrN2O3S/c1-21-15(20)11-8-9(16)5-6-12(11)18-13(19)10-4-3-7-17-14(10)22-2/h3-8H,1-2H3,(H,18,19)