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

Systemtic Name: methyl 7-(furan-2-yl)-4-oxidanylidene-1-prop-2-enyl-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate Openeye Name: methyl 1-allyl-7-(2-furyl)-4-oxo-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylate CAS Name: 7-(2-furanyl)-4-oxo-1-prop-2-enyl-2-sulfanylidene-5-pyrido[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 7-(furan-2-yl)-4-oxo-1-prop-2-enyl-2-sulfanylidenepyrido[2,3-d]pyrimidine-5-carboxylate Traditional Name: 1-allyl-7-(2-furyl)-4-keto-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid methyl ester Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=NC2=C1C(=O)NC(=S)N2CC=C)C3=CC=CO3

Isomeric SMILES

COC(=O)C1=CC(=NC2=C1C(=O)NC(=S)N2CC=C)C3=CC=CO3

InChI

InChI=1S/C16H13N3O4S/c1-3-6-19-13-12(14(20)18-16(19)24)9(15(21)22-2)8-10(17-13)11-5-4-7-23-11/h3-5,7-8H,1,6H2,2H3,(H,18,20,24)