methyl 6-(3-cyanophenyl)-4-methyl-3-(3-methylbutyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 6-(3-cyanophenyl)-4-methyl-3-(3-methylbutyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 6-(3-cyanophenyl)-3-isopentyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(3-cyanophenyl)-4-methyl-3-(3-methylbutyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-(3-cyanophenyl)-4-methyl-3-(3-methylbutyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(3-cyanophenyl)-3-isoamyl-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C19H23N3O3 MolecularWeight: 341.40422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CCC(C)C)C2=CC=CC(=C2)C#N)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1CCC(C)C)C2=CC=CC(=C2)C#N)C(=O)OC

InChI

InChI=1S/C19H23N3O3/c1-12(2)8-9-22-13(3)16(18(23)25-4)17(21-19(22)24)15-7-5-6-14(10-15)11-20/h5-7,10,12,17H,8-9H2,1-4H3,(H,21,24)