ethyl 5-cyano-6-methyl-2-oxidanylidene-4-(2-pyridin-3-ylphenyl)-1,4-dihydropyrimidine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-methyl-2-oxidanylidene-4-(2-pyridin-3-ylphenyl)-1,4-dihydropyrimidine-3-carboxylate Openeye Name: ethyl 5-cyano-6-methyl-2-oxo-4-[2-(3-pyridyl)phenyl]-1,4-dihydropyrimidine-3-carboxylate CAS Name: 5-cyano-6-methyl-2-oxo-4-[2-(3-pyridinyl)phenyl]-1,4-dihydropyrimidine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-methyl-2-oxo-4-(2-pyridin-3-ylphenyl)-1,4-dihydropyrimidine-3-carboxylate Traditional Name: 5-cyano-2-keto-6-methyl-4-[2-(3-pyridyl)phenyl]-1,4-dihydropyrimidine-3-carboxylic acid ethyl ester Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(C(=C(NC1=O)C)C#N)C2=CC=CC=C2C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)N1C(C(=C(NC1=O)C)C#N)C2=CC=CC=C2C3=CN=CC=C3

InChI

InChI=1S/C20H18N4O3/c1-3-27-20(26)24-18(17(11-21)13(2)23-19(24)25)16-9-5-4-8-15(16)14-7-6-10-22-12-14/h4-10,12,18H,3H2,1-2H3,(H,23,25)