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

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-4-methoxy-benzenesulfonamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-4-methoxy-benzenesulfonamide CAS Name: N-[3-(1,3-benzodioxol-5-ylamino)-2-quinoxalinyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-4-methoxybenzenesulfonamide Traditional Name: N-[3-(1,3-benzodioxol-5-ylamino)quinoxalin-2-yl]-4-methoxy-benzenesulfonamide Formula: C22H18N4O5S MolecularWeight: 450.46712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC5=C(C=C4)OCO5

InChI

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