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

Systemtic Name: N-[3-cyano-1-[2-(4-methoxyphenyl)ethyl]pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide Openeye Name: N-[3-cyano-1-[2-(4-methoxyphenyl)ethyl]pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide CAS Name: N-[3-cyano-1-[2-(4-methoxyphenyl)ethyl]-2-pyrrolo[3,2-b]quinoxalinyl]benzenesulfonamide IUPAC Name: N-[3-cyano-1-[2-(4-methoxyphenyl)ethyl]pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide Traditional Name: N-[3-cyano-1-[2-(4-methoxyphenyl)ethyl]pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide Formula: C26H21N5O3S MolecularWeight: 483.54164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCN2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)CCN2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H21N5O3S/c1-34-19-13-11-18(12-14-19)15-16-31-25(30-35(32,33)20-7-3-2-4-8-20)21(17-27)24-26(31)29-23-10-6-5-9-22(23)28-24/h2-14,30H,15-16H2,1H3