1-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide

Systemtic Name: 1-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide Openeye Name: 1-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]-N-(3-pyridylmethyl)piperidine-3-carboxamide CAS Name: 1-[[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]-N-(3-pyridinylmethyl)-3-piperidinecarboxamide IUPAC Name: 1-[(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methyl]-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide Traditional Name: 1-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]-N-(3-pyridylmethyl)nipecotamide Formula: C26H28N6O MolecularWeight: 440.54012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1CC(CN(C1)CC2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C26H28N6O/c33-25(28-17-21-8-6-12-27-16-21)22-9-7-13-30(19-22)20-23-18-29-32(24-10-2-1-3-11-24)26(23)31-14-4-5-15-31/h1-6,8,10-12,14-16,18,22H,7,9,13,17,19-20H2,(H,28,33)