1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-N-propyl-piperidine-3-carboxamide

Systemtic Name: 1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-N-propyl-piperidine-3-carboxamide Openeye Name: 1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)-N-propyl-piperidine-3-carboxamide CAS Name: 1-[oxo-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]-N-propyl-3-piperidinecarboxamide IUPAC Name: 1-(1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)-N-propylpiperidine-3-carboxamide Traditional Name: 1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)-N-propyl-nipecotamide Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

CCCNC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C23H27N5O2/c1-2-12-24-21(29)18-9-8-15-27(17-18)23(30)20-16-25-28(19-10-4-3-5-11-19)22(20)26-13-6-7-14-26/h3-7,10-11,13-14,16,18H,2,8-9,12,15,17H2,1H3,(H,24,29)