N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-3,4-dimethyl-benzenesulfonamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-3,4-dimethyl-benzenesulfonamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-3,4-dimethyl-benzenesulfonamide CAS Name: N-[3-(1,3-benzodioxol-5-ylamino)-2-quinoxalinyl]-3,4-dimethylbenzenesulfonamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-3,4-dimethylbenzenesulfonamide Traditional Name: N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-3,4-dimethyl-benzenesulfonamide Formula: C23H20N4O4S MolecularWeight: 448.4943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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