methyl 5-[[7-(furan-2-yl)-1,3-dimethyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[7-(furan-2-yl)-1,3-dimethyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[[7-(2-furyl)-1,3-dimethyl-2,4-dioxo-pyrimido[4,5-d]pyrimidin-5-yl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[7-(2-furanyl)-1,3-dimethyl-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[7-(furan-2-yl)-1,3-dimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[[7-(2-furyl)-2,4-diketo-1,3-dimethyl-pyrimido[4,5-d]pyrimidin-5-yl]thio]methyl]furan-2-carboxylic acid methyl ester Formula: C19H16N4O6S MolecularWeight: 428.41854

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC(=N2)C3=CC=CO3)SCC4=CC=C(O4)C(=O)OC)C(=O)N(C1=O)C

Isomeric SMILES

CN1C2=C(C(=NC(=N2)C3=CC=CO3)SCC4=CC=C(O4)C(=O)OC)C(=O)N(C1=O)C

InChI

InChI=1S/C19H16N4O6S/c1-22-15-13(17(24)23(2)19(22)26)16(21-14(20-15)11-5-4-8-28-11)30-9-10-6-7-12(29-10)18(25)27-3/h4-8H,9H2,1-3H3