N-(2-phenylpropyl)-1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-phenylpropyl)-1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(2-phenylpropyl)-1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)piperidine-4-carboxamide CAS Name: 1-[oxo-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]-N-(2-phenylpropyl)-4-piperidinecarboxamide IUPAC Name: N-(2-phenylpropyl)-1-(1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-(2-phenylpropyl)-1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)isonipecotamide Formula: C29H31N5O2 MolecularWeight: 481.58874

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(CNC(=O)C1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H31N5O2/c1-22(23-10-4-2-5-11-23)20-30-27(35)24-14-18-33(19-15-24)29(36)26-21-31-34(25-12-6-3-7-13-25)28(26)32-16-8-9-17-32/h2-13,16-17,21-22,24H,14-15,18-20H2,1H3,(H,30,35)