5-butyl-4-(3-fluorophenyl)-2-methyl-1-(3-methylbutan-2-yl)pyrrole-3-carboxamide

Systemtic Name: 5-butyl-4-(3-fluorophenyl)-2-methyl-1-(3-methylbutan-2-yl)pyrrole-3-carboxamide Openeye Name: 5-butyl-1-(1,2-dimethylpropyl)-4-(3-fluorophenyl)-2-methyl-pyrrole-3-carboxamide CAS Name: 5-butyl-4-(3-fluorophenyl)-2-methyl-1-(3-methylbutan-2-yl)-3-pyrrolecarboxamide IUPAC Name: 5-butyl-4-(3-fluorophenyl)-2-methyl-1-(3-methylbutan-2-yl)pyrrole-3-carboxamide Traditional Name: 5-butyl-1-(1,2-dimethylpropyl)-4-(3-fluorophenyl)-2-methyl-pyrrole-3-carboxamide Formula: C21H29FN2O MolecularWeight: 344.466163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1C(C)C(C)C)C)C(=O)N)C2=CC(=CC=C2)F

Isomeric SMILES

CCCCC1=C(C(=C(N1C(C)C(C)C)C)C(=O)N)C2=CC(=CC=C2)F

InChI

InChI=1S/C21H29FN2O/c1-6-7-11-18-20(16-9-8-10-17(22)12-16)19(21(23)25)15(5)24(18)14(4)13(2)3/h8-10,12-14H,6-7,11H2,1-5H3,(H2,23,25)