N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide

Systemtic Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide Openeye Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide CAS Name: N-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl]-1-(2-methyl-1-oxopropyl)-3-piperidinecarboxamide IUPAC Name: N-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide Traditional Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-1-isobutyryl-nipecotamide Formula: C26H29FN4O2 MolecularWeight: 448.532463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCCC(C1)C(=O)NCC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(=O)N1CCCC(C1)C(=O)NCC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C26H29FN4O2/c1-18(2)26(33)30-14-6-7-20(16-30)25(32)28-15-21-17-31(23-8-4-3-5-9-23)29-24(21)19-10-12-22(27)13-11-19/h3-5,8-13,17-18,20H,6-7,14-16H2,1-2H3,(H,28,32)