1-(4-methylphenyl)carbonyl-N-[(1-phenylpyrazol-4-yl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-methylphenyl)carbonyl-N-[(1-phenylpyrazol-4-yl)methyl]piperidine-3-carboxamide Openeye Name: 1-(4-methylbenzoyl)-N-[(1-phenylpyrazol-4-yl)methyl]piperidine-3-carboxamide CAS Name: 1-[(4-methylphenyl)-oxomethyl]-N-[(1-phenyl-4-pyrazolyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-methylbenzoyl)-N-[(1-phenylpyrazol-4-yl)methyl]piperidine-3-carboxamide Traditional Name: N-[(1-phenylpyrazol-4-yl)methyl]-1-p-toluoyl-nipecotamide Formula: C24H26N4O2 MolecularWeight: 402.48884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N4O2/c1-18-9-11-20(12-10-18)24(30)27-13-5-6-21(17-27)23(29)25-14-19-15-26-28(16-19)22-7-3-2-4-8-22/h2-4,7-12,15-16,21H,5-6,13-14,17H2,1H3,(H,25,29)