N-[2-(2-methylpiperidin-1-yl)ethyl]-1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(2-methylpiperidin-1-yl)ethyl]-1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[2-(2-methyl-1-piperidyl)ethyl]-1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)piperidine-4-carboxamide CAS Name: N-[2-(2-methyl-1-piperidinyl)ethyl]-1-[oxo-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(2-methylpiperidin-1-yl)ethyl]-1-(1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-[2-(2-methylpiperidino)ethyl]-1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)isonipecotamide Formula: C28H36N6O2 MolecularWeight: 488.62444

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCNC(=O)C2CCN(CC2)C(=O)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5

Isomeric SMILES

CC1CCCCN1CCNC(=O)C2CCN(CC2)C(=O)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5

InChI

InChI=1S/C28H36N6O2/c1-22-9-5-6-15-31(22)20-14-29-26(35)23-12-18-33(19-13-23)28(36)25-21-30-34(24-10-3-2-4-11-24)27(25)32-16-7-8-17-32/h2-4,7-8,10-11,16-17,21-23H,5-6,9,12-15,18-20H2,1H3,(H,29,35)