1-[(4-bromanylpyrazol-1-yl)methyl]-N-[4-chloranyl-2-(phenylcarbonyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylpyrazol-1-yl)methyl]-N-[4-chloranyl-2-(phenylcarbonyl)phenyl]pyrazole-3-carboxamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-1-[(4-bromopyrazol-1-yl)methyl]pyrazole-3-carboxamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-1-[(4-bromo-1-pyrazolyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-1-[(4-bromopyrazol-1-yl)methyl]pyrazole-3-carboxamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-1-[(4-bromopyrazol-1-yl)methyl]pyrazole-3-carboxamide Formula: C21H15BrClN5O2 MolecularWeight: 484.7331

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)NC(=O)C3=NN(C=C3)CN4C=C(C=N4)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)NC(=O)C3=NN(C=C3)CN4C=C(C=N4)Br

InChI

InChI=1S/C21H15BrClN5O2/c22-15-11-24-28(12-15)13-27-9-8-19(26-27)21(30)25-18-7-6-16(23)10-17(18)20(29)14-4-2-1-3-5-14/h1-12H,13H2,(H,25,30)