phenylcarbonyl 4-oxidanylidene-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxylate

Systemtic Name: phenylcarbonyl 4-oxidanylidene-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxylate Openeye Name: benzoyl 4-oxo-2-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxylate CAS Name: 4-oxo-2-sulfanylidene-1,5-dihydro[1]benzopyrano[2,3-d]pyrimidine-7-carboxylic acid benzoyl ester IUPAC Name: benzoyl 4-oxo-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxylate Traditional Name: 4-keto-2-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidine-7-carboxylic acid benzoyl ester Formula: C19H12N2O5S MolecularWeight: 380.37398

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C(=O)OC(=O)C3=CC=CC=C3)OC4=C1C(=O)NC(=S)N4

Isomeric SMILES

C1C2=C(C=CC(=C2)C(=O)OC(=O)C3=CC=CC=C3)OC4=C1C(=O)NC(=S)N4

InChI

InChI=1S/C19H12N2O5S/c22-15-13-9-12-8-11(6-7-14(12)25-16(13)21-19(27)20-15)18(24)26-17(23)10-4-2-1-3-5-10/h1-8H,9H2,(H2,20,21,22,27)