ethyl 5-cyano-4-cyclohexyl-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylate

Systemtic Name: ethyl 5-cyano-4-cyclohexyl-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylate Openeye Name: ethyl 5-cyano-4-cyclohexyl-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylate CAS Name: 5-cyano-4-cyclohexyl-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-4-cyclohexyl-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylate Traditional Name: 5-cyano-4-cyclohexyl-2-keto-6-methyl-1,4-dihydropyrimidine-3-carboxylic acid ethyl ester Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(C(=C(NC1=O)C)C#N)C2CCCCC2

Isomeric SMILES

CCOC(=O)N1C(C(=C(NC1=O)C)C#N)C2CCCCC2

InChI

InChI=1S/C15H21N3O3/c1-3-21-15(20)18-13(11-7-5-4-6-8-11)12(9-16)10(2)17-14(18)19/h11,13H,3-8H2,1-2H3,(H,17,19)