methyl 4-(2-chloranyl-4-fluoranyl-phenyl)-6-methyl-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 4-(2-chloranyl-4-fluoranyl-phenyl)-6-methyl-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: methyl 4-(2-chloro-4-fluoro-phenyl)-6-methyl-2-(2-pyridyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(2-chloro-4-fluorophenyl)-6-methyl-2-(2-pyridinyl)-1,4-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(2-chloro-4-fluorophenyl)-6-methyl-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(2-chloro-4-fluoro-phenyl)-6-methyl-2-(2-pyridyl)-1,4-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C18H15ClFN3O2 MolecularWeight: 359.782003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1)C2=CC=CC=N2)C3=C(C=C(C=C3)F)Cl)C(=O)OC

Isomeric SMILES

CC1=C(C(N=C(N1)C2=CC=CC=N2)C3=C(C=C(C=C3)F)Cl)C(=O)OC

InChI

InChI=1S/C18H15ClFN3O2/c1-10-15(18(24)25-2)16(12-7-6-11(20)9-13(12)19)23-17(22-10)14-5-3-4-8-21-14/h3-9,16H,1-2H3,(H,22,23)