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

Systemtic Name: 4-(3-fluorophenyl)-2-methyl-1-(3-methylbutyl)-5-pentyl-pyrrole-3-carboxamide Openeye Name: 4-(3-fluorophenyl)-1-isopentyl-2-methyl-5-pentyl-pyrrole-3-carboxamide CAS Name: 4-(3-fluorophenyl)-2-methyl-1-(3-methylbutyl)-5-pentyl-3-pyrrolecarboxamide IUPAC Name: 4-(3-fluorophenyl)-2-methyl-1-(3-methylbutyl)-5-pentylpyrrole-3-carboxamide Traditional Name: 5-amyl-4-(3-fluorophenyl)-1-isoamyl-2-methyl-pyrrole-3-carboxamide Formula: C22H31FN2O MolecularWeight: 358.492743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31FN2O/c1-5-6-7-11-19-21(17-9-8-10-18(23)14-17)20(22(24)26)16(4)25(19)13-12-15(2)3/h8-10,14-15H,5-7,11-13H2,1-4H3,(H2,24,26)