N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-2,5-dimethyl-benzenesulfonamide CAS Name: N-[3-(1,3-benzodioxol-5-ylamino)-2-quinoxalinyl]-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-2,5-dimethylbenzenesulfonamide Traditional Name: N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-2,5-dimethyl-benzenesulfonamide Formula: C23H20N4O4S MolecularWeight: 448.4943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H20N4O4S/c1-14-7-8-15(2)21(11-14)32(28,29)27-23-22(25-17-5-3-4-6-18(17)26-23)24-16-9-10-19-20(12-16)31-13-30-19/h3-12H,13H2,1-2H3,(H,24,25)(H,26,27)