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

Systemtic Name: methyl 4-(2-chlorophenyl)-2-pyridin-2-yl-6-pyridin-3-yl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: methyl 4-(2-chlorophenyl)-2-(2-pyridyl)-6-(3-pyridyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(2-chlorophenyl)-2-(2-pyridinyl)-6-(3-pyridinyl)-1,4-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(2-chlorophenyl)-2-pyridin-2-yl-6-pyridin-3-yl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(2-chlorophenyl)-2-(2-pyridyl)-6-(3-pyridyl)-1,4-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C22H17ClN4O2 MolecularWeight: 404.84898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17ClN4O2/c1-29-22(28)18-19(14-7-6-11-24-13-14)26-21(17-10-4-5-12-25-17)27-20(18)15-8-2-3-9-16(15)23/h2-13,20H,1H3,(H,26,27)