5-butyl-2-methyl-1-(3-methylbutyl)-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide

Systemtic Name: 5-butyl-2-methyl-1-(3-methylbutyl)-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Openeye Name: 5-butyl-1-isopentyl-2-methyl-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide CAS Name: 5-butyl-2-methyl-1-(3-methylbutyl)-4-[4-(trifluoromethyl)phenyl]-3-pyrrolecarboxamide IUPAC Name: 5-butyl-2-methyl-1-(3-methylbutyl)-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Traditional Name: 5-butyl-1-isoamyl-2-methyl-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Formula: C22H29F3N2O MolecularWeight: 394.47367

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C22H29F3N2O/c1-5-6-7-18-20(16-8-10-17(11-9-16)22(23,24)25)19(21(26)28)15(4)27(18)13-12-14(2)3/h8-11,14H,5-7,12-13H2,1-4H3,(H2,26,28)