ethyl 4-azanyl-7-cyano-8-methyl-9-methylsulfanyl-6-oxidanylidene-pyrido[1,2-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 4-azanyl-7-cyano-8-methyl-9-methylsulfanyl-6-oxidanylidene-pyrido[1,2-a]pyrimidine-3-carboxylate Openeye Name: ethyl 4-amino-7-cyano-8-methyl-9-methylsulfanyl-6-oxo-pyrido[1,2-a]pyrimidine-3-carboxylate CAS Name: 4-amino-7-cyano-8-methyl-9-(methylthio)-6-oxo-3-pyrido[1,2-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-7-cyano-8-methyl-9-methylsulfanyl-6-oxopyrido[1,2-a]pyrimidine-3-carboxylate Traditional Name: 4-amino-7-cyano-6-keto-8-methyl-9-(methylthio)pyrido[1,2-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C14H14N4O3S MolecularWeight: 318.35096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N2C(=C(C(=C(C2=O)C#N)C)SC)N=C1)N

Isomeric SMILES

CCOC(=O)C1=C(N2C(=C(C(=C(C2=O)C#N)C)SC)N=C1)N

InChI

InChI=1S/C14H14N4O3S/c1-4-21-14(20)9-6-17-12-10(22-3)7(2)8(5-15)13(19)18(12)11(9)16/h6H,4,16H2,1-3H3