N-butan-2-yl-4-[5-(4-phenylbutanoylamino)pyrazol-1-yl]piperidine-1-carboxamide

Systemtic Name: N-butan-2-yl-4-[5-(4-phenylbutanoylamino)pyrazol-1-yl]piperidine-1-carboxamide Openeye Name: 4-[5-(4-phenylbutanoylamino)pyrazol-1-yl]-N-sec-butyl-piperidine-1-carboxamide CAS Name: N-butan-2-yl-4-[5-[(1-oxo-4-phenylbutyl)amino]-1-pyrazolyl]-1-piperidinecarboxamide IUPAC Name: N-butan-2-yl-4-[5-(4-phenylbutanoylamino)pyrazol-1-yl]piperidine-1-carboxamide Traditional Name: 4-[5-(4-phenylbutanoylamino)pyrazol-1-yl]-N-sec-butyl-piperidine-1-carboxamide Formula: C23H33N5O2 MolecularWeight: 411.54042

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)CCCC3=CC=CC=C3

Isomeric SMILES

CCC(C)NC(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C23H33N5O2/c1-3-18(2)25-23(30)27-16-13-20(14-17-27)28-21(12-15-24-28)26-22(29)11-7-10-19-8-5-4-6-9-19/h4-6,8-9,12,15,18,20H,3,7,10-11,13-14,16-17H2,1-2H3,(H,25,30)(H,26,29)