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

Systemtic Name: N-[2-[butyl(ethyl)amino]ethyl]-1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[2-[butyl(ethyl)amino]ethyl]-1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)piperidine-4-carboxamide CAS Name: N-[2-[butyl(ethyl)amino]ethyl]-1-[oxo-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-[butyl(ethyl)amino]ethyl]-1-(1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-[2-[butyl(ethyl)amino]ethyl]-1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)isonipecotamide Formula: C28H38N6O2 MolecularWeight: 490.64032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)CCNC(=O)C1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

CCCCN(CC)CCNC(=O)C1CCN(CC1)C(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C28H38N6O2/c1-3-5-16-31(4-2)21-15-29-26(35)23-13-19-33(20-14-23)28(36)25-22-30-34(24-11-7-6-8-12-24)27(25)32-17-9-10-18-32/h6-12,17-18,22-23H,3-5,13-16,19-21H2,1-2H3,(H,29,35)