prop-2-enyl 4-(2-chlorophenyl)-2-(3-fluoranylpyridin-2-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: prop-2-enyl 4-(2-chlorophenyl)-2-(3-fluoranylpyridin-2-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: allyl 4-(2-chlorophenyl)-2-(3-fluoro-2-pyridyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(2-chlorophenyl)-2-(3-fluoro-2-pyridinyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-(2-chlorophenyl)-2-(3-fluoropyridin-2-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(2-chlorophenyl)-2-(3-fluoro-2-pyridyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid allyl ester Formula: C20H17ClFN3O2 MolecularWeight: 385.819283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1)C2=C(C=CC=N2)F)C3=CC=CC=C3Cl)C(=O)OCC=C

Isomeric SMILES

CC1=C(C(N=C(N1)C2=C(C=CC=N2)F)C3=CC=CC=C3Cl)C(=O)OCC=C

InChI

InChI=1S/C20H17ClFN3O2/c1-3-11-27-20(26)16-12(2)24-19(18-15(22)9-6-10-23-18)25-17(16)13-7-4-5-8-14(13)21/h3-10,17H,1,11H2,2H3,(H,24,25)