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

Systemtic Name: N-(3-cyano-1-pentyl-pyrrolo[3,2-b]quinoxalin-2-yl)-4-methyl-benzenesulfonamide Openeye Name: N-(3-cyano-1-pentyl-pyrrolo[3,2-b]quinoxalin-2-yl)-4-methyl-benzenesulfonamide CAS Name: N-(3-cyano-1-pentyl-2-pyrrolo[3,2-b]quinoxalinyl)-4-methylbenzenesulfonamide IUPAC Name: N-(3-cyano-1-pentylpyrrolo[3,2-b]quinoxalin-2-yl)-4-methylbenzenesulfonamide Traditional Name: N-(1-amyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-4-methyl-benzenesulfonamide Formula: C23H23N5O2S MolecularWeight: 433.52602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H23N5O2S/c1-3-4-7-14-28-22(27-31(29,30)17-12-10-16(2)11-13-17)18(15-24)21-23(28)26-20-9-6-5-8-19(20)25-21/h5-6,8-13,27H,3-4,7,14H2,1-2H3