propan-2-yl 6-(3-cyanophenyl)-4-methyl-2-oxidanylidene-3-(phenylmethyl)-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 6-(3-cyanophenyl)-4-methyl-2-oxidanylidene-3-(phenylmethyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl 3-benzyl-6-(3-cyanophenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(3-cyanophenyl)-4-methyl-2-oxo-3-(phenylmethyl)-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-benzyl-6-(3-cyanophenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-benzyl-6-(3-cyanophenyl)-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CC2=CC=CC=C2)C3=CC=CC(=C3)C#N)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(NC(=O)N1CC2=CC=CC=C2)C3=CC=CC(=C3)C#N)C(=O)OC(C)C

InChI

InChI=1S/C23H23N3O3/c1-15(2)29-22(27)20-16(3)26(14-17-8-5-4-6-9-17)23(28)25-21(20)19-11-7-10-18(12-19)13-24/h4-12,15,21H,14H2,1-3H3,(H,25,28)