4,5-bis(bromanyl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]-1H-pyrazole-3-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]-1H-pyrazole-3-carboxamide Openeye Name: 4,5-dibromo-N-[(1,3-diphenylpyrazol-4-yl)methyl]-1H-pyrazole-3-carboxamide CAS Name: 4,5-dibromo-N-[(1,3-diphenyl-4-pyrazolyl)methyl]-1H-pyrazole-3-carboxamide IUPAC Name: 4,5-dibromo-N-[(1,3-diphenylpyrazol-4-yl)methyl]-1H-pyrazole-3-carboxamide Traditional Name: 4,5-dibromo-N-[(1,3-diphenylpyrazol-4-yl)methyl]-1H-pyrazole-3-carboxamide Formula: C20H15Br2N5O MolecularWeight: 501.174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)C3=NNC(=C3Br)Br)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)C3=NNC(=C3Br)Br)C4=CC=CC=C4

InChI

InChI=1S/C20H15Br2N5O/c21-16-18(24-25-19(16)22)20(28)23-11-14-12-27(15-9-5-2-6-10-15)26-17(14)13-7-3-1-4-8-13/h1-10,12H,11H2,(H,23,28)(H,24,25)