ethyl 4-(4-bromophenyl)-2-(3-fluoranylpyridin-2-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-(3-fluoranylpyridin-2-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-(3-fluoro-2-pyridyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(4-bromophenyl)-2-(3-fluoro-2-pyridinyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-(3-fluoropyridin-2-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(4-bromophenyl)-2-(3-fluoro-2-pyridyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C19H17BrFN3O2 MolecularWeight: 418.259583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=NC1C2=CC=C(C=C2)Br)C3=C(C=CC=N3)F)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=NC1C2=CC=C(C=C2)Br)C3=C(C=CC=N3)F)C

InChI

InChI=1S/C19H17BrFN3O2/c1-3-26-19(25)15-11(2)23-18(17-14(21)5-4-10-22-17)24-16(15)12-6-8-13(20)9-7-12/h4-10,16H,3H2,1-2H3,(H,23,24)