ethyl 2-[(5-bromanylpyridin-3-yl)carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(5-bromanylpyridin-3-yl)carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[(5-bromopyridine-3-carbonyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[(5-bromopyridine-3-carbonyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[(5-bromonicotinoyl)amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C16H15BrN2O4S MolecularWeight: 411.2703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C16H15BrN2O4S/c1-4-23-16(22)12-8(2)13(9(3)20)24-15(12)19-14(21)10-5-11(17)7-18-6-10/h5-7H,4H2,1-3H3,(H,19,21)