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

Systemtic Name: 2,4-bis(chloranyl)-N-(3-cyano-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzamide Openeye Name: 2,4-dichloro-N-(3-cyano-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzamide CAS Name: 2,4-dichloro-N-(3-cyano-1-phenethyl-2-pyrrolo[3,2-b]quinoxalinyl)benzamide IUPAC Name: 2,4-dichloro-N-(3-cyano-1-phenethylpyrrolo[3,2-b]quinoxalin-2-yl)benzamide Traditional Name: 2,4-dichloro-N-(3-cyano-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzamide Formula: C26H17Cl2N5O MolecularWeight: 486.35208

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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=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C26H17Cl2N5O/c27-17-10-11-18(20(28)14-17)26(34)32-24-19(15-29)23-25(31-22-9-5-4-8-21(22)30-23)33(24)13-12-16-6-2-1-3-7-16/h1-11,14H,12-13H2,(H,32,34)