1-[[3-(2-chlorophenyl)-1-(4-fluorophenyl)pyrazol-4-yl]methyl]piperidine-3-carboxamide

Systemtic Name: 1-[[3-(2-chlorophenyl)-1-(4-fluorophenyl)pyrazol-4-yl]methyl]piperidine-3-carboxamide Openeye Name: 1-[[3-(2-chlorophenyl)-1-(4-fluorophenyl)pyrazol-4-yl]methyl]piperidine-3-carboxamide CAS Name: 1-[[3-(2-chlorophenyl)-1-(4-fluorophenyl)-4-pyrazolyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-[[3-(2-chlorophenyl)-1-(4-fluorophenyl)pyrazol-4-yl]methyl]piperidine-3-carboxamide Traditional Name: 1-[[3-(2-chlorophenyl)-1-(4-fluorophenyl)pyrazol-4-yl]methyl]nipecotamide Formula: C22H22ClFN4O MolecularWeight: 412.887683

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CN(N=C2C3=CC=CC=C3Cl)C4=CC=C(C=C4)F)C(=O)N

Isomeric SMILES

C1CC(CN(C1)CC2=CN(N=C2C3=CC=CC=C3Cl)C4=CC=C(C=C4)F)C(=O)N

InChI

InChI=1S/C22H22ClFN4O/c23-20-6-2-1-5-19(20)21-16(13-27-11-3-4-15(12-27)22(25)29)14-28(26-21)18-9-7-17(24)8-10-18/h1-2,5-10,14-15H,3-4,11-13H2,(H2,25,29)