N-[1-(phenylcarbonyl)piperidin-4-yl]-1-(phenylmethyl)-3-pyridin-3-yl-pyrazole-4-carboxamide

Systemtic Name: N-[1-(phenylcarbonyl)piperidin-4-yl]-1-(phenylmethyl)-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: N-(1-benzoyl-4-piperidyl)-1-benzyl-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-(1-benzoyl-4-piperidinyl)-1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: N-(1-benzoylpiperidin-4-yl)-1-benzyl-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: N-(1-benzoyl-4-piperidyl)-1-benzyl-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C28H27N5O2 MolecularWeight: 465.54628

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H27N5O2/c34-27(30-24-13-16-32(17-14-24)28(35)22-10-5-2-6-11-22)25-20-33(19-21-8-3-1-4-9-21)31-26(25)23-12-7-15-29-18-23/h1-12,15,18,20,24H,13-14,16-17,19H2,(H,30,34)