methyl 4-(9-methoxy-4-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidin-2-yl)benzoate

Systemtic Name: methyl 4-(9-methoxy-4-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidin-2-yl)benzoate Openeye Name: methyl 4-(9-methoxy-4-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidin-2-yl)benzoate CAS Name: 4-(9-methoxy-4-sulfanylidene-1,5-dihydro[1]benzopyrano[2,3-d]pyrimidin-2-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(9-methoxy-4-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidin-2-yl)benzoate Traditional Name: 4-(9-methoxy-4-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidin-2-yl)benzoic acid methyl ester Formula: C20H16N2O4S MolecularWeight: 380.41704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC3=C(C2)C(=S)N=C(N3)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

COC1=CC=CC2=C1OC3=C(C2)C(=S)N=C(N3)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C20H16N2O4S/c1-24-15-5-3-4-13-10-14-18(26-16(13)15)21-17(22-19(14)27)11-6-8-12(9-7-11)20(23)25-2/h3-9H,10H2,1-2H3,(H,21,22,27)