methyl 2-[3-methyl-2-methylsulfanyl-4,7-bis(oxidanylidene)-8H-pteridin-6-yl]ethanoate

Systemtic Name: methyl 2-[3-methyl-2-methylsulfanyl-4,7-bis(oxidanylidene)-8H-pteridin-6-yl]ethanoate Openeye Name: methyl 2-(3-methyl-2-methylsulfanyl-4,7-dioxo-8H-pteridin-6-yl)acetate CAS Name: 2-[3-methyl-2-(methylthio)-4,7-dioxo-8H-pteridin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-(3-methyl-2-methylsulfanyl-4,7-dioxo-8H-pteridin-6-yl)acetate Traditional Name: 2-[4,7-diketo-3-methyl-2-(methylthio)-8H-pteridin-6-yl]acetic acid methyl ester Formula: C11H12N4O4S MolecularWeight: 296.30238

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(NC(=O)C(=N2)CC(=O)OC)N=C1SC

Isomeric SMILES

CN1C(=O)C2=C(NC(=O)C(=N2)CC(=O)OC)N=C1SC

InChI

InChI=1S/C11H12N4O4S/c1-15-10(18)7-8(14-11(15)20-3)13-9(17)5(12-7)4-6(16)19-2/h4H2,1-3H3,(H,13,17)