ethyl 7-methyl-4-oxidanylidene-3-phenyl-2-prop-2-enylsulfanyl-pyrido[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 7-methyl-4-oxidanylidene-3-phenyl-2-prop-2-enylsulfanyl-pyrido[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 2-allylsulfanyl-7-methyl-4-oxo-3-phenyl-pyrido[2,3-d]pyrimidine-5-carboxylate CAS Name: 7-methyl-4-oxo-3-phenyl-2-(prop-2-enylthio)-5-pyrido[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-methyl-4-oxo-3-phenyl-2-prop-2-enylsulfanylpyrido[2,3-d]pyrimidine-5-carboxylate Traditional Name: 2-(allylthio)-4-keto-7-methyl-3-phenyl-pyrido[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NC2=C1C(=O)N(C(=N2)SCC=C)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CC(=NC2=C1C(=O)N(C(=N2)SCC=C)C3=CC=CC=C3)C

InChI

InChI=1S/C20H19N3O3S/c1-4-11-27-20-22-17-16(15(12-13(3)21-17)19(25)26-5-2)18(24)23(20)14-9-7-6-8-10-14/h4,6-10,12H,1,5,11H2,2-3H3