diethyl 2-methylsulfanyl-4-oxidanylidene-1H-pyrido[3,2-d]pyrimidine-6,7-dicarboxylate

Systemtic Name: diethyl 2-methylsulfanyl-4-oxidanylidene-1H-pyrido[3,2-d]pyrimidine-6,7-dicarboxylate Openeye Name: diethyl 2-methylsulfanyl-4-oxo-1H-pyrido[3,2-d]pyrimidine-6,7-dicarboxylate CAS Name: 2-(methylthio)-4-oxo-1H-pyrido[3,2-d]pyrimidine-6,7-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-methylsulfanyl-4-oxo-1H-pyrido[3,2-d]pyrimidine-6,7-dicarboxylate Traditional Name: 4-keto-2-(methylthio)-1H-pyrido[3,2-d]pyrimidine-6,7-dicarboxylic acid diethyl ester Formula: C14H15N3O5S MolecularWeight: 337.351

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C(=O)N=C(N2)SC)N=C1C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC2=C(C(=O)N=C(N2)SC)N=C1C(=O)OCC

InChI

InChI=1S/C14H15N3O5S/c1-4-21-12(19)7-6-8-10(11(18)17-14(15-8)23-3)16-9(7)13(20)22-5-2/h6H,4-5H2,1-3H3,(H,15,17,18)