1-[[3,4-bis(fluoranyl)phenyl]methyl]-4-(4-bromophenyl)-5-butyl-2-methyl-pyrrole-3-carboxamide

Systemtic Name: 1-[[3,4-bis(fluoranyl)phenyl]methyl]-4-(4-bromophenyl)-5-butyl-2-methyl-pyrrole-3-carboxamide Openeye Name: 4-(4-bromophenyl)-5-butyl-1-[(3,4-difluorophenyl)methyl]-2-methyl-pyrrole-3-carboxamide CAS Name: 4-(4-bromophenyl)-5-butyl-1-[(3,4-difluorophenyl)methyl]-2-methyl-3-pyrrolecarboxamide IUPAC Name: 4-(4-bromophenyl)-5-butyl-1-[(3,4-difluorophenyl)methyl]-2-methylpyrrole-3-carboxamide Traditional Name: 4-(4-bromophenyl)-5-butyl-1-(3,4-difluorobenzyl)-2-methyl-pyrrole-3-carboxamide Formula: C23H23BrF2N2O MolecularWeight: 461.342326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CC2=CC(=C(C=C2)F)F)C)C(=O)N)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCC1=C(C(=C(N1CC2=CC(=C(C=C2)F)F)C)C(=O)N)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H23BrF2N2O/c1-3-4-5-20-22(16-7-9-17(24)10-8-16)21(23(27)29)14(2)28(20)13-15-6-11-18(25)19(26)12-15/h6-12H,3-5,13H2,1-2H3,(H2,27,29)