5-butyl-2-methyl-1-(3-oxidanylpropyl)-4-quinolin-2-yl-pyrrole-3-carboxamide

Systemtic Name: 5-butyl-2-methyl-1-(3-oxidanylpropyl)-4-quinolin-2-yl-pyrrole-3-carboxamide Openeye Name: 5-butyl-1-(3-hydroxypropyl)-2-methyl-4-(2-quinolyl)pyrrole-3-carboxamide CAS Name: 5-butyl-1-(3-hydroxypropyl)-2-methyl-4-(2-quinolinyl)-3-pyrrolecarboxamide IUPAC Name: 5-butyl-1-(3-hydroxypropyl)-2-methyl-4-quinolin-2-ylpyrrole-3-carboxamide Traditional Name: 5-butyl-1-(3-hydroxypropyl)-2-methyl-4-(2-quinolyl)pyrrole-3-carboxamide Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCCO)C)C(=O)N)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCC1=C(C(=C(N1CCCO)C)C(=O)N)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H27N3O2/c1-3-4-10-19-21(18-12-11-16-8-5-6-9-17(16)24-18)20(22(23)27)15(2)25(19)13-7-14-26/h5-6,8-9,11-12,26H,3-4,7,10,13-14H2,1-2H3,(H2,23,27)