N-methyl-4-(1H-pyrrol-2-ylcarbonylamino)-1-(2-quinolin-4-ylethanoyl)piperidine-4-carboxamide

Systemtic Name: N-methyl-4-(1H-pyrrol-2-ylcarbonylamino)-1-(2-quinolin-4-ylethanoyl)piperidine-4-carboxamide Openeye Name: N-methyl-4-(1H-pyrrole-2-carbonylamino)-1-[2-(4-quinolyl)acetyl]piperidine-4-carboxamide CAS Name: N-methyl-4-[[oxo(1H-pyrrol-2-yl)methyl]amino]-1-[1-oxo-2-(4-quinolinyl)ethyl]-4-piperidinecarboxamide IUPAC Name: N-methyl-4-(1H-pyrrole-2-carbonylamino)-1-(2-quinolin-4-ylacetyl)piperidine-4-carboxamide Traditional Name: N-methyl-4-(1H-pyrrole-2-carbonylamino)-1-[2-(4-quinolyl)acetyl]isonipecotamide Formula: C23H25N5O3 MolecularWeight: 419.4763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1(CCN(CC1)C(=O)CC2=CC=NC3=CC=CC=C23)NC(=O)C4=CC=CN4

Isomeric SMILES

CNC(=O)C1(CCN(CC1)C(=O)CC2=CC=NC3=CC=CC=C23)NC(=O)C4=CC=CN4

InChI

InChI=1S/C23H25N5O3/c1-24-22(31)23(27-21(30)19-7-4-11-25-19)9-13-28(14-10-23)20(29)15-16-8-12-26-18-6-3-2-5-17(16)18/h2-8,11-12,25H,9-10,13-15H2,1H3,(H,24,31)(H,27,30)