(3S)-1-[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperidine-3-carboxamide

Systemtic Name: (3S)-1-[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperidine-3-carboxamide Openeye Name: (3S)-1-[3-(4-fluorophenyl)-1-phenyl-pyrazole-4-carbonyl]piperidine-3-carboxamide CAS Name: (3S)-1-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-[3-(4-fluorophenyl)-1-phenylpyrazole-4-carbonyl]piperidine-3-carboxamide Traditional Name: (3S)-1-[3-(4-fluorophenyl)-1-phenyl-pyrazole-4-carbonyl]nipecotamide Formula: C22H21FN4O2 MolecularWeight: 392.426143

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C22H21FN4O2/c23-17-10-8-15(9-11-17)20-19(14-27(25-20)18-6-2-1-3-7-18)22(29)26-12-4-5-16(13-26)21(24)28/h1-3,6-11,14,16H,4-5,12-13H2,(H2,24,28)/t16-/m0/s1