N-[2,4-bis(fluoranyl)phenyl]-1-(2-chlorophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-1-(2-chlorophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide Openeye Name: 1-(2-chlorophenyl)-N-(2,4-difluorophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide CAS Name: 1-(2-chlorophenyl)-N-(2,4-difluorophenyl)-5-(4-piperidinyl)-4-pyrazolecarboxamide IUPAC Name: 1-(2-chlorophenyl)-N-(2,4-difluorophenyl)-5-piperidin-4-ylpyrazole-4-carboxamide Traditional Name: 1-(2-chlorophenyl)-N-(2,4-difluorophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide Formula: C21H19ClF2N4O MolecularWeight: 416.851566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C(C=NN2C3=CC=CC=C3Cl)C(=O)NC4=C(C=C(C=C4)F)F

Isomeric SMILES

C1CNCCC1C2=C(C=NN2C3=CC=CC=C3Cl)C(=O)NC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C21H19ClF2N4O/c22-16-3-1-2-4-19(16)28-20(13-7-9-25-10-8-13)15(12-26-28)21(29)27-18-6-5-14(23)11-17(18)24/h1-6,11-13,25H,7-10H2,(H,27,29)