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

Systemtic Name: methyl 4-(2-chlorophenyl)-6-(3-oxidanylidene-3-phenylazanyl-propyl)-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: methyl 6-(3-anilino-3-oxo-propyl)-4-(2-chlorophenyl)-2-(2-pyridyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 6-(3-anilino-3-oxopropyl)-4-(2-chlorophenyl)-2-(2-pyridinyl)-1,4-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-(3-anilino-3-oxopropyl)-4-(2-chlorophenyl)-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 6-(3-anilino-3-keto-propyl)-4-(2-chlorophenyl)-2-(2-pyridyl)-1,4-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C26H23ClN4O3 MolecularWeight: 474.93882

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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)NC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(NC(=NC1C2=CC=CC=C2Cl)C3=CC=CC=N3)CCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H23ClN4O3/c1-34-26(33)23-20(14-15-22(32)29-17-9-3-2-4-10-17)30-25(21-13-7-8-16-28-21)31-24(23)18-11-5-6-12-19(18)27/h2-13,16,24H,14-15H2,1H3,(H,29,32)(H,30,31)