ethyl 2-(2-methylsulfanyl-5-oxidanylidene-pyrido[4,3-d]pyrimidin-6-yl)ethanoate

Systemtic Name: ethyl 2-(2-methylsulfanyl-5-oxidanylidene-pyrido[4,3-d]pyrimidin-6-yl)ethanoate Openeye Name: ethyl 2-(2-methylsulfanyl-5-oxo-pyrido[4,3-d]pyrimidin-6-yl)acetate CAS Name: 2-[2-(methylthio)-5-oxo-6-pyrido[4,3-d]pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(2-methylsulfanyl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetate Traditional Name: 2-[5-keto-2-(methylthio)pyrido[4,3-d]pyrimidin-6-yl]acetic acid ethyl ester Formula: C12H13N3O3S MolecularWeight: 279.31492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=CC2=NC(=NC=C2C1=O)SC

Isomeric SMILES

CCOC(=O)CN1C=CC2=NC(=NC=C2C1=O)SC

InChI

InChI=1S/C12H13N3O3S/c1-3-18-10(16)7-15-5-4-9-8(11(15)17)6-13-12(14-9)19-2/h4-6H,3,7H2,1-2H3