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

Systemtic Name: methyl 4-(4-bromophenyl)-2-(3-fluoranylpyridin-2-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C18H15BrFN3O2 MolecularWeight: 404.233003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15BrFN3O2/c1-10-14(18(24)25-2)15(11-5-7-12(19)8-6-11)23-17(22-10)16-13(20)4-3-9-21-16/h3-9,15H,1-2H3,(H,22,23)