1-ethyl-7-(3-nitrophenyl)-4-oxidanylidene-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylic acid

Systemtic Name: 1-ethyl-7-(3-nitrophenyl)-4-oxidanylidene-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylic acid Openeye Name: 1-ethyl-7-(3-nitrophenyl)-4-oxo-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid CAS Name: 1-ethyl-7-(3-nitrophenyl)-4-oxo-2-sulfanylidene-5-pyrido[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 1-ethyl-7-(3-nitrophenyl)-4-oxo-2-sulfanylidenepyrido[2,3-d]pyrimidine-5-carboxylic acid Traditional Name: 1-ethyl-4-keto-7-(3-nitrophenyl)-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid Formula: C16H12N4O5S MolecularWeight: 372.35528

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=CC(=N2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O)C(=O)NC1=S

Isomeric SMILES

CCN1C2=C(C(=CC(=N2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O)C(=O)NC1=S

InChI

InChI=1S/C16H12N4O5S/c1-2-19-13-12(14(21)18-16(19)26)10(15(22)23)7-11(17-13)8-4-3-5-9(6-8)20(24)25/h3-7H,2H2,1H3,(H,22,23)(H,18,21,26)