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

Systemtic Name: N-[3-cyano-1-(4-methylphenyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[3-cyano-1-(p-tolyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-methyl-benzenesulfonamide CAS Name: N-[3-cyano-1-(4-methylphenyl)-2-pyrrolo[3,2-b]quinoxalinyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-cyano-1-(4-methylphenyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[3-cyano-1-(p-tolyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-methyl-benzenesulfonamide Formula: C25H19N5O2S MolecularWeight: 453.51566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)NS(=O)(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)NS(=O)(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C25H19N5O2S/c1-16-7-11-18(12-8-16)30-24(29-33(31,32)19-13-9-17(2)10-14-19)20(15-26)23-25(30)28-22-6-4-3-5-21(22)27-23/h3-14,29H,1-2H3