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

Systemtic Name: [2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl] 5-bromanylpyridine-3-carboxylate Openeye Name: [2-[(3-carbamoyl-2-thienyl)amino]-2-oxo-ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-[(3-carbamoyl-2-thienyl)amino]-2-keto-ethyl] ester Formula: C13H10BrN3O4S MolecularWeight: 384.2052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1C(=O)N)NC(=O)COC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

C1=CSC(=C1C(=O)N)NC(=O)COC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C13H10BrN3O4S/c14-8-3-7(4-16-5-8)13(20)21-6-10(18)17-12-9(11(15)19)1-2-22-12/h1-5H,6H2,(H2,15,19)(H,17,18)