[2-(5-methylthiophen-2-yl)-2-oxidanylidene-ethyl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [2-(5-methylthiophen-2-yl)-2-oxidanylidene-ethyl] 5-bromanylpyridine-3-carboxylate Openeye Name: [2-(5-methyl-2-thienyl)-2-oxo-ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [2-(5-methyl-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-methylthiophen-2-yl)-2-oxoethyl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-keto-2-(5-methyl-2-thienyl)ethyl] ester Formula: C13H10BrNO3S MolecularWeight: 340.1924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)COC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CC1=CC=C(S1)C(=O)COC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C13H10BrNO3S/c1-8-2-3-12(19-8)11(16)7-18-13(17)9-4-10(14)6-15-5-9/h2-6H,7H2,1H3