methyl 4-oxidanylidene-1-prop-2-enyl-7-pyridin-3-yl-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: methyl 4-oxidanylidene-1-prop-2-enyl-7-pyridin-3-yl-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate Openeye Name: methyl 1-allyl-4-oxo-7-(3-pyridyl)-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-oxo-1-prop-2-enyl-7-(3-pyridinyl)-2-sulfanylidene-5-pyrido[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-oxo-1-prop-2-enyl-7-pyridin-3-yl-2-sulfanylidenepyrido[2,3-d]pyrimidine-5-carboxylate Traditional Name: 1-allyl-4-keto-7-(3-pyridyl)-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid methyl ester Formula: C17H14N4O3S MolecularWeight: 354.38306

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=NC2=C1C(=O)NC(=S)N2CC=C)C3=CN=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=NC2=C1C(=O)NC(=S)N2CC=C)C3=CN=CC=C3

InChI

InChI=1S/C17H14N4O3S/c1-3-7-21-14-13(15(22)20-17(21)25)11(16(23)24-2)8-12(19-14)10-5-4-6-18-9-10/h3-6,8-9H,1,7H2,2H3,(H,20,22,25)