1-(3,5-dimethylphenyl)carbonyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide

Systemtic Name: 1-(3,5-dimethylphenyl)carbonyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide Openeye Name: 1-(3,5-dimethylbenzoyl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide CAS Name: 1-[(3,5-dimethylphenyl)-oxomethyl]-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-(3,5-dimethylbenzoyl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide Traditional Name: 1-(3,5-dimethylbenzoyl)-N-[2-(pyrazol-1-ylmethyl)benzyl]nipecotamide Formula: C26H30N4O2 MolecularWeight: 430.542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N2CCCC(C2)C(=O)NCC3=CC=CC=C3CN4C=CC=N4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N2CCCC(C2)C(=O)NCC3=CC=CC=C3CN4C=CC=N4)C

InChI

InChI=1S/C26H30N4O2/c1-19-13-20(2)15-24(14-19)26(32)29-11-5-9-23(17-29)25(31)27-16-21-7-3-4-8-22(21)18-30-12-6-10-28-30/h3-4,6-8,10,12-15,23H,5,9,11,16-18H2,1-2H3,(H,27,31)