4-(4-bromophenyl)-2-methyl-5-propyl-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide

Systemtic Name: 4-(4-bromophenyl)-2-methyl-5-propyl-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Openeye Name: 4-(4-bromophenyl)-2-methyl-5-propyl-1-(2-pyridylmethyl)pyrrole-3-carboxamide CAS Name: 4-(4-bromophenyl)-2-methyl-5-propyl-1-(2-pyridinylmethyl)-3-pyrrolecarboxamide IUPAC Name: 4-(4-bromophenyl)-2-methyl-5-propyl-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Traditional Name: 4-(4-bromophenyl)-2-methyl-5-propyl-1-(2-pyridylmethyl)pyrrole-3-carboxamide Formula: C21H22BrN3O MolecularWeight: 412.32288

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(N1CC2=CC=CC=N2)C)C(=O)N)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCC1=C(C(=C(N1CC2=CC=CC=N2)C)C(=O)N)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H22BrN3O/c1-3-6-18-20(15-8-10-16(22)11-9-15)19(21(23)26)14(2)25(18)13-17-7-4-5-12-24-17/h4-5,7-12H,3,6,13H2,1-2H3,(H2,23,26)