1-(2-bromophenyl)-N-butyl-3-cyano-pyrrole-2-carboxamide

Systemtic Name: 1-(2-bromophenyl)-N-butyl-3-cyano-pyrrole-2-carboxamide Openeye Name: 1-(2-bromophenyl)-N-butyl-3-cyano-pyrrole-2-carboxamide CAS Name: 1-(2-bromophenyl)-N-butyl-3-cyano-2-pyrrolecarboxamide IUPAC Name: 1-(2-bromophenyl)-N-butyl-3-cyanopyrrole-2-carboxamide Traditional Name: 1-(2-bromophenyl)-N-butyl-3-cyano-pyrrole-2-carboxamide Formula: C16H16BrN3O MolecularWeight: 346.22174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(C=CN1C2=CC=CC=C2Br)C#N

Isomeric SMILES

CCCCNC(=O)C1=C(C=CN1C2=CC=CC=C2Br)C#N

InChI

InChI=1S/C16H16BrN3O/c1-2-3-9-19-16(21)15-12(11-18)8-10-20(15)14-7-5-4-6-13(14)17/h4-8,10H,2-3,9H2,1H3,(H,19,21)