methyl 1-methyl-7-(3-nitrophenyl)-4-oxidanylidene-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=CC(=N2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC)C(=O)NC1=S

Isomeric SMILES

CN1C2=C(C(=CC(=N2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC)C(=O)NC1=S

InChI

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