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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC=C(C=C3)F)C4CCNCC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC=C(C=C3)F)C4CCNCC4)Cl

InChI

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