N-(2-chloranyl-4-fluoranyl-phenyl)-1-phenyl-5-piperidin-4-yl-pyrazole-4-carboxamide

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-1-phenyl-5-piperidin-4-yl-pyrazole-4-carboxamide Openeye Name: N-(2-chloro-4-fluoro-phenyl)-1-phenyl-5-(4-piperidyl)pyrazole-4-carboxamide CAS Name: N-(2-chloro-4-fluorophenyl)-1-phenyl-5-(4-piperidinyl)-4-pyrazolecarboxamide IUPAC Name: N-(2-chloro-4-fluorophenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide Traditional Name: N-(2-chloro-4-fluoro-phenyl)-1-phenyl-5-(4-piperidyl)pyrazole-4-carboxamide Formula: C21H20ClFN4O MolecularWeight: 398.861103

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C(C=NN2C3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CNCCC1C2=C(C=NN2C3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C21H20ClFN4O/c22-18-12-15(23)6-7-19(18)26-21(28)17-13-25-27(16-4-2-1-3-5-16)20(17)14-8-10-24-11-9-14/h1-7,12-14,24H,8-11H2,(H,26,28)