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

Systemtic Name: 1-(3-bromophenyl)-N-butyl-3-cyano-pyrrole-2-carboxamide Openeye Name: 1-(3-bromophenyl)-N-butyl-3-cyano-pyrrole-2-carboxamide CAS Name: 1-(3-bromophenyl)-N-butyl-3-cyano-2-pyrrolecarboxamide IUPAC Name: 1-(3-bromophenyl)-N-butyl-3-cyanopyrrole-2-carboxamide Traditional Name: 1-(3-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=C2)Br)C#N

Isomeric SMILES

CCCCNC(=O)C1=C(C=CN1C2=CC(=CC=C2)Br)C#N

InChI

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