methyl 4-(2-chlorophenyl)-6-[3-(2-hydroxyethylamino)-3-oxidanylidene-propyl]-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 4-(2-chlorophenyl)-6-[3-(2-hydroxyethylamino)-3-oxidanylidene-propyl]-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: methyl 4-(2-chlorophenyl)-6-[3-(2-hydroxyethylamino)-3-oxo-propyl]-2-(2-pyridyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(2-chlorophenyl)-6-[3-(2-hydroxyethylamino)-3-oxopropyl]-2-(2-pyridinyl)-1,4-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(2-chlorophenyl)-6-[3-(2-hydroxyethylamino)-3-oxopropyl]-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(2-chlorophenyl)-6-[3-(2-hydroxyethylamino)-3-keto-propyl]-2-(2-pyridyl)-1,4-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C22H23ClN4O4 MolecularWeight: 442.89542

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC(=NC1C2=CC=CC=C2Cl)C3=CC=CC=N3)CCC(=O)NCCO

Isomeric SMILES

COC(=O)C1=C(NC(=NC1C2=CC=CC=C2Cl)C3=CC=CC=N3)CCC(=O)NCCO

InChI

InChI=1S/C22H23ClN4O4/c1-31-22(30)19-16(9-10-18(29)25-12-13-28)26-21(17-8-4-5-11-24-17)27-20(19)14-6-2-3-7-15(14)23/h2-8,11,20,28H,9-10,12-13H2,1H3,(H,25,29)(H,26,27)