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

Systemtic Name: 5-butyl-2-methyl-4-quinolin-2-yl-1-(2-thiophen-2-ylethyl)pyrrole-3-carboxamide Openeye Name: 5-butyl-2-methyl-4-(2-quinolyl)-1-[2-(2-thienyl)ethyl]pyrrole-3-carboxamide CAS Name: 5-butyl-2-methyl-4-(2-quinolinyl)-1-(2-thiophen-2-ylethyl)-3-pyrrolecarboxamide IUPAC Name: 5-butyl-2-methyl-4-quinolin-2-yl-1-(2-thiophen-2-ylethyl)pyrrole-3-carboxamide Traditional Name: 5-butyl-2-methyl-4-(2-quinolyl)-1-[2-(2-thienyl)ethyl]pyrrole-3-carboxamide Formula: C25H27N3OS MolecularWeight: 417.56638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCC2=CC=CS2)C)C(=O)N)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCCCC1=C(C(=C(N1CCC2=CC=CS2)C)C(=O)N)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H27N3OS/c1-3-4-11-22-24(21-13-12-18-8-5-6-10-20(18)27-21)23(25(26)29)17(2)28(22)15-14-19-9-7-16-30-19/h5-10,12-13,16H,3-4,11,14-15H2,1-2H3,(H2,26,29)