1-[(3R)-5-(4-bromophenyl)-3-(1,3-diphenylpyrazol-4-yl)-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 1-[(3R)-5-(4-bromophenyl)-3-(1,3-diphenylpyrazol-4-yl)-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[(3R)-5-(4-bromophenyl)-3-(1,3-diphenylpyrazol-4-yl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[(3R)-5-(4-bromophenyl)-3-(1,3-diphenyl-4-pyrazolyl)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[(3R)-5-(4-bromophenyl)-3-(1,3-diphenylpyrazol-4-yl)-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[(5R)-3-(4-bromophenyl)-5-(1,3-diphenylpyrazol-4-yl)-2-pyrazolin-1-yl]ethanone Formula: C26H21BrN4O MolecularWeight: 485.37514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=N1)C2=CC=C(C=C2)Br)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)N1[C@H](CC(=N1)C2=CC=C(C=C2)Br)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H21BrN4O/c1-18(32)31-25(16-24(28-31)19-12-14-21(27)15-13-19)23-17-30(22-10-6-3-7-11-22)29-26(23)20-8-4-2-5-9-20/h2-15,17,25H,16H2,1H3/t25-/m1/s1