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

Systemtic Name: (phenylmethyl) 4-(3-chlorophenyl)-6-methyl-2-oxidanylidene-3-(3-phenylpropylcarbamoyl)-1,4-dihydropyrimidine-5-carboxylate Openeye Name: benzyl 4-(3-chlorophenyl)-6-methyl-2-oxo-3-(3-phenylpropylcarbamoyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(3-chlorophenyl)-6-methyl-2-oxo-3-[oxo-(3-phenylpropylamino)methyl]-1,4-dihydropyrimidine-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(3-chlorophenyl)-6-methyl-2-oxo-3-(3-phenylpropylcarbamoyl)-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(3-chlorophenyl)-2-keto-6-methyl-3-(3-phenylpropylcarbamoyl)-1,4-dihydropyrimidine-5-carboxylic acid benzyl ester Formula: C29H28ClN3O4 MolecularWeight: 518.00332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)C(=O)NCCCC2=CC=CC=C2)C3=CC(=CC=C3)Cl)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(N(C(=O)N1)C(=O)NCCCC2=CC=CC=C2)C3=CC(=CC=C3)Cl)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H28ClN3O4/c1-20-25(27(34)37-19-22-12-6-3-7-13-22)26(23-15-8-16-24(30)18-23)33(29(36)32-20)28(35)31-17-9-14-21-10-4-2-5-11-21/h2-8,10-13,15-16,18,26H,9,14,17,19H2,1H3,(H,31,35)(H,32,36)