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

Systemtic Name: N-[3-cyano-1-(phenylmethyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-(1-benzyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-4-methyl-benzenesulfonamide CAS Name: N-[3-cyano-1-(phenylmethyl)-2-pyrrolo[3,2-b]quinoxalinyl]-4-methylbenzenesulfonamide IUPAC Name: N-(1-benzyl-3-cyanopyrrolo[3,2-b]quinoxalin-2-yl)-4-methylbenzenesulfonamide Traditional Name: N-(1-benzyl-3-cyano-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)S(=O)(=O)NC2=C(C3=NC4=CC=CC=C4N=C3N2CC5=CC=CC=C5)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C3=NC4=CC=CC=C4N=C3N2CC5=CC=CC=C5)C#N

InChI

InChI=1S/C25H19N5O2S/c1-17-11-13-19(14-12-17)33(31,32)29-24-20(15-26)23-25(28-22-10-6-5-9-21(22)27-23)30(24)16-18-7-3-2-4-8-18/h2-14,29H,16H2,1H3