(phenylmethyl) 4-(3-chlorophenyl)-6-methyl-2-oxidanylidene-3-(2-pyridin-4-ylethylcarbamoyl)-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: (phenylmethyl) 4-(3-chlorophenyl)-6-methyl-2-oxidanylidene-3-(2-pyridin-4-ylethylcarbamoyl)-1,4-dihydropyrimidine-5-carboxylate Openeye Name: benzyl 4-(3-chlorophenyl)-6-methyl-2-oxo-3-[2-(4-pyridyl)ethylcarbamoyl]-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(3-chlorophenyl)-6-methyl-2-oxo-3-[oxo-(2-pyridin-4-ylethylamino)methyl]-1,4-dihydropyrimidine-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(3-chlorophenyl)-6-methyl-2-oxo-3-(2-pyridin-4-ylethylcarbamoyl)-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(3-chlorophenyl)-2-keto-6-methyl-3-[2-(4-pyridyl)ethylcarbamoyl]-1,4-dihydropyrimidine-5-carboxylic acid benzyl ester Formula: C27H25ClN4O4 MolecularWeight: 504.9648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)C(=O)NCCC2=CC=NC=C2)C3=CC(=CC=C3)Cl)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(N(C(=O)N1)C(=O)NCCC2=CC=NC=C2)C3=CC(=CC=C3)Cl)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H25ClN4O4/c1-18-23(25(33)36-17-20-6-3-2-4-7-20)24(21-8-5-9-22(28)16-21)32(27(35)31-18)26(34)30-15-12-19-10-13-29-14-11-19/h2-11,13-14,16,24H,12,15,17H2,1H3,(H,30,34)(H,31,35)