4-bromanyl-N-(3-cyano-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzamide

Systemtic Name: 4-bromanyl-N-(3-cyano-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzamide Openeye Name: 4-bromo-N-(3-cyano-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzamide CAS Name: 4-bromo-N-(3-cyano-1-phenethyl-2-pyrrolo[3,2-b]quinoxalinyl)benzamide IUPAC Name: 4-bromo-N-(3-cyano-1-phenethylpyrrolo[3,2-b]quinoxalin-2-yl)benzamide Traditional Name: 4-bromo-N-(3-cyano-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzamide Formula: C26H18BrN5O MolecularWeight: 496.35802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)NC(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)NC(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C26H18BrN5O/c27-19-12-10-18(11-13-19)26(33)31-24-20(16-28)23-25(30-22-9-5-4-8-21(22)29-23)32(24)15-14-17-6-2-1-3-7-17/h1-13H,14-15H2,(H,31,33)