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

Systemtic Name: 3-bromanyl-N-(3-cyano-1-prop-2-enyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzamide Openeye Name: N-(1-allyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-3-bromo-benzamide CAS Name: 3-bromo-N-(3-cyano-1-prop-2-enyl-2-pyrrolo[3,2-b]quinoxalinyl)benzamide IUPAC Name: 3-bromo-N-(3-cyano-1-prop-2-enylpyrrolo[3,2-b]quinoxalin-2-yl)benzamide Traditional Name: N-(1-allyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-3-bromo-benzamide Formula: C21H14BrN5O MolecularWeight: 432.27276

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

C=CCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H14BrN5O/c1-2-10-27-19(26-21(28)13-6-5-7-14(22)11-13)15(12-23)18-20(27)25-17-9-4-3-8-16(17)24-18/h2-9,11H,1,10H2,(H,26,28)