1-[3-(3,4-dimethylphenyl)-1-(phenylmethyl)pyrazol-4-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[3-(3,4-dimethylphenyl)-1-(phenylmethyl)pyrazol-4-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[1-benzyl-3-(3,4-dimethylphenyl)pyrazole-4-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[3-(3,4-dimethylphenyl)-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[1-benzyl-3-(3,4-dimethylphenyl)pyrazole-4-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[1-benzyl-3-(3,4-dimethylphenyl)pyrazole-4-carbonyl]isonipecotamide Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)N3CCC(CC3)C(=O)N)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)N3CCC(CC3)C(=O)N)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H28N4O2/c1-17-8-9-21(14-18(17)2)23-22(16-29(27-23)15-19-6-4-3-5-7-19)25(31)28-12-10-20(11-13-28)24(26)30/h3-9,14,16,20H,10-13,15H2,1-2H3,(H2,26,30)