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

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylamino)-6-methoxy-quinoxalin-2-yl]benzenesulfonamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylamino)-6-methoxy-quinoxalin-2-yl]benzenesulfonamide CAS Name: N-[3-(1,3-benzodioxol-5-ylamino)-6-methoxy-2-quinoxalinyl]benzenesulfonamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylamino)-6-methoxyquinoxalin-2-yl]benzenesulfonamide Traditional Name: N-[3-(1,3-benzodioxol-5-ylamino)-6-methoxy-quinoxalin-2-yl]benzenesulfonamide Formula: C22H18N4O5S MolecularWeight: 450.46712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C(=N2)NC3=CC4=C(C=C3)OCO4)NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C(=N2)NC3=CC4=C(C=C3)OCO4)NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C22H18N4O5S/c1-29-15-8-9-17-18(12-15)25-21(23-14-7-10-19-20(11-14)31-13-30-19)22(24-17)26-32(27,28)16-5-3-2-4-6-16/h2-12H,13H2,1H3,(H,23,25)(H,24,26)