(4-bromophenyl)-[5-(1,3-diphenylpyrazol-4-yl)-3-phenyl-3,4-dihydropyrazol-2-yl]methanone

Systemtic Name: (4-bromophenyl)-[5-(1,3-diphenylpyrazol-4-yl)-3-phenyl-3,4-dihydropyrazol-2-yl]methanone Openeye Name: (4-bromophenyl)-[5-(1,3-diphenylpyrazol-4-yl)-3-phenyl-3,4-dihydropyrazol-2-yl]methanone CAS Name: (4-bromophenyl)-[5-(1,3-diphenyl-4-pyrazolyl)-3-phenyl-3,4-dihydropyrazol-2-yl]methanone IUPAC Name: (4-bromophenyl)-[5-(1,3-diphenylpyrazol-4-yl)-3-phenyl-3,4-dihydropyrazol-2-yl]methanone Traditional Name: (4-bromophenyl)-[3-(1,3-diphenylpyrazol-4-yl)-5-phenyl-2-pyrazolin-1-yl]methanone Formula: C31H23BrN4O MolecularWeight: 547.44452

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Br)C6=CC=CC=C6

Isomeric SMILES

C1C(N(N=C1C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Br)C6=CC=CC=C6

InChI

InChI=1S/C31H23BrN4O/c32-25-18-16-24(17-19-25)31(37)36-29(22-10-4-1-5-11-22)20-28(33-36)27-21-35(26-14-8-3-9-15-26)34-30(27)23-12-6-2-7-13-23/h1-19,21,29H,20H2