N-[3-[(3,5-dimethoxyphenyl)amino]quinoxalin-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[3-[(3,5-dimethoxyphenyl)amino]quinoxalin-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[3-(3,5-dimethoxyanilino)-2-quinoxalinyl]-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C26H27N5O6S2 MolecularWeight: 569.65248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5)OC

InChI

InChI=1S/C26H27N5O6S2/c1-36-19-15-18(16-20(17-19)37-2)27-25-26(29-24-8-4-3-7-23(24)28-25)30-38(32,33)21-9-11-22(12-10-21)39(34,35)31-13-5-6-14-31/h3-4,7-12,15-17H,5-6,13-14H2,1-2H3,(H,27,28)(H,29,30)