3-(4-bromophenyl)carbonyl-N,1,5-triphenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(4-bromophenyl)carbonyl-N,1,5-triphenyl-pyrazole-4-carboxamide Openeye Name: 3-(4-bromobenzoyl)-N,1,5-triphenyl-pyrazole-4-carboxamide CAS Name: 3-[(4-bromophenyl)-oxomethyl]-N,1,5-triphenyl-4-pyrazolecarboxamide IUPAC Name: 3-(4-bromobenzoyl)-N,1,5-triphenylpyrazole-4-carboxamide Traditional Name: 3-(4-bromobenzoyl)-N,1,5-triphenyl-pyrazole-4-carboxamide Formula: C29H20BrN3O2 MolecularWeight: 522.392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br)C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C29H20BrN3O2/c30-22-18-16-21(17-19-22)28(34)26-25(29(35)31-23-12-6-2-7-13-23)27(20-10-4-1-5-11-20)33(32-26)24-14-8-3-9-15-24/h1-19H,(H,31,35)