2-methyl-1-(3-methylbutyl)-5-pentyl-4-quinolin-2-yl-pyrrole-3-carboxamide

Systemtic Name: 2-methyl-1-(3-methylbutyl)-5-pentyl-4-quinolin-2-yl-pyrrole-3-carboxamide Openeye Name: 1-isopentyl-2-methyl-5-pentyl-4-(2-quinolyl)pyrrole-3-carboxamide CAS Name: 2-methyl-1-(3-methylbutyl)-5-pentyl-4-(2-quinolinyl)-3-pyrrolecarboxamide IUPAC Name: 2-methyl-1-(3-methylbutyl)-5-pentyl-4-quinolin-2-ylpyrrole-3-carboxamide Traditional Name: 5-amyl-1-isoamyl-2-methyl-4-(2-quinolyl)pyrrole-3-carboxamide Formula: C25H33N3O MolecularWeight: 391.54902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C25H33N3O/c1-5-6-7-12-22-24(21-14-13-19-10-8-9-11-20(19)27-21)23(25(26)29)18(4)28(22)16-15-17(2)3/h8-11,13-14,17H,5-7,12,15-16H2,1-4H3,(H2,26,29)