4,5-bis(bromanyl)-N-(4-phenylphenyl)-1H-pyrazole-3-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-N-(4-phenylphenyl)-1H-pyrazole-3-carboxamide Openeye Name: 4,5-dibromo-N-(4-phenylphenyl)-1H-pyrazole-3-carboxamide CAS Name: 4,5-dibromo-N-(4-phenylphenyl)-1H-pyrazole-3-carboxamide IUPAC Name: 4,5-dibromo-N-(4-phenylphenyl)-1H-pyrazole-3-carboxamide Traditional Name: 4,5-dibromo-N-(4-phenylphenyl)-1H-pyrazole-3-carboxamide Formula: C16H11Br2N3O MolecularWeight: 421.08604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)C3=NNC(=C3Br)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)C3=NNC(=C3Br)Br

InChI

InChI=1S/C16H11Br2N3O/c17-13-14(20-21-15(13)18)16(22)19-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,(H,19,22)(H,20,21)