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

Systemtic Name: 2-phenoxyethyl 4-(2-chlorophenyl)-2-(3-fluoranylpyridin-2-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: 2-phenoxyethyl 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 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 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 2-phenoxyethyl ester Formula: C25H21ClFN3O3 MolecularWeight: 465.903943

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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)OCCOC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(N=C(N1)C2=C(C=CC=N2)F)C3=CC=CC=C3Cl)C(=O)OCCOC4=CC=CC=C4

InChI

InChI=1S/C25H21ClFN3O3/c1-16-21(25(31)33-15-14-32-17-8-3-2-4-9-17)22(18-10-5-6-11-19(18)26)30-24(29-16)23-20(27)12-7-13-28-23/h2-13,22H,14-15H2,1H3,(H,29,30)