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

Systemtic Name: 4-chloranyl-N-[3-cyano-1-(phenylmethyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide Openeye Name: N-(1-benzyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-4-chloro-benzamide CAS Name: 4-chloro-N-[3-cyano-1-(phenylmethyl)-2-pyrrolo[3,2-b]quinoxalinyl]benzamide IUPAC Name: N-(1-benzyl-3-cyanopyrrolo[3,2-b]quinoxalin-2-yl)-4-chlorobenzamide Traditional Name: N-(1-benzyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-4-chloro-benzamide Formula: C25H16ClN5O MolecularWeight: 437.88044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)NC(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)NC(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H16ClN5O/c26-18-12-10-17(11-13-18)25(32)30-23-19(14-27)22-24(29-21-9-5-4-8-20(21)28-22)31(23)15-16-6-2-1-3-7-16/h1-13H,15H2,(H,30,32)