4-(3-chlorophenyl)-3-[ethyl(pyridin-3-yl)carbamoyl]-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-5-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)-3-[ethyl(pyridin-3-yl)carbamoyl]-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-5-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-3-[ethyl(3-pyridyl)carbamoyl]-6-methyl-2-oxo-1,4-dihydropyrimidine-5-carboxylic acid CAS Name: 4-(3-chlorophenyl)-3-[[ethyl(3-pyridinyl)amino]-oxomethyl]-6-methyl-2-oxo-1,4-dihydropyrimidine-5-carboxylic acid IUPAC Name: 4-(3-chlorophenyl)-3-[ethyl(pyridin-3-yl)carbamoyl]-6-methyl-2-oxo-1,4-dihydropyrimidine-5-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-3-[ethyl(3-pyridyl)carbamoyl]-2-keto-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid Formula: C20H19ClN4O4 MolecularWeight: 414.84226

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CN=CC=C1)C(=O)N2C(C(=C(NC2=O)C)C(=O)O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCN(C1=CN=CC=C1)C(=O)N2C(C(=C(NC2=O)C)C(=O)O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H19ClN4O4/c1-3-24(15-8-5-9-22-11-15)20(29)25-17(13-6-4-7-14(21)10-13)16(18(26)27)12(2)23-19(25)28/h4-11,17H,3H2,1-2H3,(H,23,28)(H,26,27)