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

Systemtic Name: 5-butyl-2-methyl-1-phenethyl-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Openeye Name: 5-butyl-2-methyl-1-phenethyl-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide CAS Name: 5-butyl-2-methyl-1-phenethyl-4-[4-(trifluoromethyl)phenyl]-3-pyrrolecarboxamide IUPAC Name: 5-butyl-2-methyl-1-phenethyl-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Traditional Name: 5-butyl-2-methyl-1-phenethyl-4-[4-(trifluoromethyl)phenyl]pyrrole-3-carboxamide Formula: C25H27F3N2O MolecularWeight: 428.48989

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCC2=CC=CC=C2)C)C(=O)N)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCCCC1=C(C(=C(N1CCC2=CC=CC=C2)C)C(=O)N)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C25H27F3N2O/c1-3-4-10-21-23(19-11-13-20(14-12-19)25(26,27)28)22(24(29)31)17(2)30(21)16-15-18-8-6-5-7-9-18/h5-9,11-14H,3-4,10,15-16H2,1-2H3,(H2,29,31)