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

Systemtic Name: 2-methyl-1-(3-methylbutyl)-5-pentyl-4-pyridin-3-yl-pyrrole-3-carboxamide Openeye Name: 1-isopentyl-2-methyl-5-pentyl-4-(3-pyridyl)pyrrole-3-carboxamide CAS Name: 2-methyl-1-(3-methylbutyl)-5-pentyl-4-(3-pyridinyl)-3-pyrrolecarboxamide IUPAC Name: 2-methyl-1-(3-methylbutyl)-5-pentyl-4-pyridin-3-ylpyrrole-3-carboxamide Traditional Name: 5-amyl-1-isoamyl-2-methyl-4-(3-pyridyl)pyrrole-3-carboxamide Formula: C21H31N3O MolecularWeight: 341.49034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=CN=CC=C2

Isomeric SMILES

CCCCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=CN=CC=C2

InChI

InChI=1S/C21H31N3O/c1-5-6-7-10-18-20(17-9-8-12-23-14-17)19(21(22)25)16(4)24(18)13-11-15(2)3/h8-9,12,14-15H,5-7,10-11,13H2,1-4H3,(H2,22,25)