N-[3-(1,3-benzodioxol-5-ylamino)-6,7-dimethyl-quinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylamino)-6,7-dimethyl-quinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylamino)-6,7-dimethyl-quinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: N-[3-(1,3-benzodioxol-5-ylamino)-6,7-dimethyl-2-quinoxalinyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylamino)-6,7-dimethylquinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[3-(1,3-benzodioxol-5-ylamino)-6,7-dimethyl-quinoxalin-2-yl]-2-(trifluoromethyl)benzenesulfonamide Formula: C24H19F3N4O4S MolecularWeight: 516.49227

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(C(=N2)NC3=CC4=C(C=C3)OCO4)NS(=O)(=O)C5=CC=CC=C5C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(C(=N2)NC3=CC4=C(C=C3)OCO4)NS(=O)(=O)C5=CC=CC=C5C(F)(F)F

InChI

InChI=1S/C24H19F3N4O4S/c1-13-9-17-18(10-14(13)2)30-23(22(29-17)28-15-7-8-19-20(11-15)35-12-34-19)31-36(32,33)21-6-4-3-5-16(21)24(25,26)27/h3-11H,12H2,1-2H3,(H,28,29)(H,30,31)