1-[(3R)-5-(6-bromanyl-2-methyl-4-phenyl-quinolin-3-yl)-3-(4-fluorophenyl)-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 1-[(3R)-5-(6-bromanyl-2-methyl-4-phenyl-quinolin-3-yl)-3-(4-fluorophenyl)-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[(3R)-5-(6-bromo-2-methyl-4-phenyl-3-quinolyl)-3-(4-fluorophenyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[(3R)-5-(6-bromo-2-methyl-4-phenyl-3-quinolinyl)-3-(4-fluorophenyl)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[(3R)-5-(6-bromo-2-methyl-4-phenylquinolin-3-yl)-3-(4-fluorophenyl)-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[(5R)-3-(6-bromo-2-methyl-4-phenyl-3-quinolyl)-5-(4-fluorophenyl)-2-pyrazolin-1-yl]ethanone Formula: C27H21BrFN3O MolecularWeight: 502.377543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=C(C=CC2=N1)Br)C3=CC=CC=C3)C4=NN(C(C4)C5=CC=C(C=C5)F)C(=O)C

Isomeric SMILES

CC1=C(C(=C2C=C(C=CC2=N1)Br)C3=CC=CC=C3)C4=NN([C@H](C4)C5=CC=C(C=C5)F)C(=O)C

InChI

InChI=1S/C27H21BrFN3O/c1-16-26(24-15-25(32(31-24)17(2)33)18-8-11-21(29)12-9-18)27(19-6-4-3-5-7-19)22-14-20(28)10-13-23(22)30-16/h3-14,25H,15H2,1-2H3/t25-/m1/s1