1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)-N-(2-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[[3-methyl-1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-N-(2-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(3-methyl-1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)-N-(2-pyridylmethyl)isonipecotamide Formula: C27H28N6O2 MolecularWeight: 468.55022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=N3)N4C=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=N3)N4C=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H28N6O2/c1-20-24(26(31-15-7-8-16-31)33(30-20)23-10-3-2-4-11-23)27(35)32-17-12-21(13-18-32)25(34)29-19-22-9-5-6-14-28-22/h2-11,14-16,21H,12-13,17-19H2,1H3,(H,29,34)