1-(3-chloranyl-2-methyl-phenyl)-N-(3-fluorophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-N-(3-fluorophenyl)-5-piperidin-4-yl-pyrazole-4-carboxamide Openeye Name: 1-(3-chloro-2-methyl-phenyl)-N-(3-fluorophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide CAS Name: 1-(3-chloro-2-methylphenyl)-N-(3-fluorophenyl)-5-(4-piperidinyl)-4-pyrazolecarboxamide IUPAC Name: 1-(3-chloro-2-methylphenyl)-N-(3-fluorophenyl)-5-piperidin-4-ylpyrazole-4-carboxamide Traditional Name: 1-(3-chloro-2-methyl-phenyl)-N-(3-fluorophenyl)-5-(4-piperidyl)pyrazole-4-carboxamide Formula: C22H22ClFN4O MolecularWeight: 412.887683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=C(C=N2)C(=O)NC3=CC(=CC=C3)F)C4CCNCC4

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=C(C=N2)C(=O)NC3=CC(=CC=C3)F)C4CCNCC4

InChI

InChI=1S/C22H22ClFN4O/c1-14-19(23)6-3-7-20(14)28-21(15-8-10-25-11-9-15)18(13-26-28)22(29)27-17-5-2-4-16(24)12-17/h2-7,12-13,15,25H,8-11H2,1H3,(H,27,29)