ethyl 4-oxidanylidene-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-8-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-8-carboxylate Openeye Name: ethyl 4-oxo-2-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidine-8-carboxylate CAS Name: 4-oxo-2-sulfanylidene-1,5-dihydro[1]benzopyrano[2,3-d]pyrimidine-8-carboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-8-carboxylate Traditional Name: 4-keto-2-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidine-8-carboxylic acid ethyl ester Formula: C14H12N2O4S MolecularWeight: 304.32108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(CC3=C(O2)NC(=S)NC3=O)C=C1

Isomeric SMILES

CCOC(=O)C1=CC2=C(CC3=C(O2)NC(=S)NC3=O)C=C1

InChI

InChI=1S/C14H12N2O4S/c1-2-19-13(18)8-4-3-7-5-9-11(17)15-14(21)16-12(9)20-10(7)6-8/h3-4,6H,2,5H2,1H3,(H2,15,16,17,21)