1-[[3-(4-bromophenyl)-1H-pyrazol-5-yl]carbonyl]-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[[3-(4-bromophenyl)-1H-pyrazol-5-yl]carbonyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[[3-(4-bromophenyl)-1H-pyrazol-5-yl]-oxomethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]-N-phenyl-isonipecotamide Formula: C22H21BrN4O2 MolecularWeight: 453.33174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H21BrN4O2/c23-17-8-6-15(7-9-17)19-14-20(26-25-19)22(29)27-12-10-16(11-13-27)21(28)24-18-4-2-1-3-5-18/h1-9,14,16H,10-13H2,(H,24,28)(H,25,26)