1-(3,5-dimethylphenyl)carbonyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]piperidine-3-carboxamide

Systemtic Name: 1-(3,5-dimethylphenyl)carbonyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]piperidine-3-carboxamide Openeye Name: 1-(3,5-dimethylbenzoyl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]piperidine-3-carboxamide CAS Name: 1-[(3,5-dimethylphenyl)-oxomethyl]-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(3,5-dimethylbenzoyl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]piperidine-3-carboxamide Traditional Name: 1-(3,5-dimethylbenzoyl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]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)NCCC3=CC=C(C=C3)N4C=CC=N4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N2CCCC(C2)C(=O)NCCC3=CC=C(C=C3)N4C=CC=N4)C

InChI

InChI=1S/C26H30N4O2/c1-19-15-20(2)17-23(16-19)26(32)29-13-3-5-22(18-29)25(31)27-12-10-21-6-8-24(9-7-21)30-14-4-11-28-30/h4,6-9,11,14-17,22H,3,5,10,12-13,18H2,1-2H3,(H,27,31)