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

Systemtic Name: 4-chloranyl-N-(3-cyano-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzenesulfonamide Openeye Name: 4-chloro-N-(3-cyano-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzenesulfonamide CAS Name: 4-chloro-N-(3-cyano-1-phenethyl-2-pyrrolo[3,2-b]quinoxalinyl)benzenesulfonamide IUPAC Name: 4-chloro-N-(3-cyano-1-phenethylpyrrolo[3,2-b]quinoxalin-2-yl)benzenesulfonamide Traditional Name: 4-chloro-N-(3-cyano-1-phenethyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzenesulfonamide Formula: C25H18ClN5O2S MolecularWeight: 487.96072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H18ClN5O2S/c26-18-10-12-19(13-11-18)34(32,33)30-24-20(16-27)23-25(29-22-9-5-4-8-21(22)28-23)31(24)15-14-17-6-2-1-3-7-17/h1-13,30H,14-15H2