N-[1-(3-bromophenyl)ethyl]-2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide

Systemtic Name: N-[1-(3-bromophenyl)ethyl]-2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Openeye Name: N-[1-(3-bromophenyl)ethyl]-2,5-dimethyl-1-(2-pyridylmethyl)pyrrole-3-carboxamide CAS Name: N-[1-(3-bromophenyl)ethyl]-2,5-dimethyl-1-(2-pyridinylmethyl)-3-pyrrolecarboxamide IUPAC Name: N-[1-(3-bromophenyl)ethyl]-2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Traditional Name: N-[1-(3-bromophenyl)ethyl]-2,5-dimethyl-1-(2-pyridylmethyl)pyrrole-3-carboxamide Formula: C21H22BrN3O MolecularWeight: 412.32288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=N2)C)C(=O)NC(C)C3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=N2)C)C(=O)NC(C)C3=CC(=CC=C3)Br

InChI

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