4-(3-chlorophenyl)-6-methyl-2-oxidanylidene-3-(4-phenylbutylcarbamoyl)-1,4-dihydropyrimidine-5-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)-6-methyl-2-oxidanylidene-3-(4-phenylbutylcarbamoyl)-1,4-dihydropyrimidine-5-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-6-methyl-2-oxo-3-(4-phenylbutylcarbamoyl)-1,4-dihydropyrimidine-5-carboxylic acid CAS Name: 4-(3-chlorophenyl)-6-methyl-2-oxo-3-[oxo-(4-phenylbutylamino)methyl]-1,4-dihydropyrimidine-5-carboxylic acid IUPAC Name: 4-(3-chlorophenyl)-6-methyl-2-oxo-3-(4-phenylbutylcarbamoyl)-1,4-dihydropyrimidine-5-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-2-keto-6-methyl-3-(4-phenylbutylcarbamoyl)-1,4-dihydropyrimidine-5-carboxylic acid Formula: C23H24ClN3O4 MolecularWeight: 441.90736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)C(=O)NCCCCC2=CC=CC=C2)C3=CC(=CC=C3)Cl)C(=O)O

Isomeric SMILES

CC1=C(C(N(C(=O)N1)C(=O)NCCCCC2=CC=CC=C2)C3=CC(=CC=C3)Cl)C(=O)O

InChI

InChI=1S/C23H24ClN3O4/c1-15-19(21(28)29)20(17-11-7-12-18(24)14-17)27(23(31)26-15)22(30)25-13-6-5-10-16-8-3-2-4-9-16/h2-4,7-9,11-12,14,20H,5-6,10,13H2,1H3,(H,25,30)(H,26,31)(H,28,29)