N-[3-[(3,5-dimethoxyphenyl)amino]quinoxalin-2-yl]-6-(hydroxymethyl)pyridine-3-sulfonamide

Systemtic Name: N-[3-[(3,5-dimethoxyphenyl)amino]quinoxalin-2-yl]-6-(hydroxymethyl)pyridine-3-sulfonamide Openeye Name: N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]-6-(hydroxymethyl)pyridine-3-sulfonamide CAS Name: N-[3-(3,5-dimethoxyanilino)-2-quinoxalinyl]-6-(hydroxymethyl)-3-pyridinesulfonamide IUPAC Name: N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]-6-(hydroxymethyl)pyridine-3-sulfonamide Traditional Name: N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]-6-methylol-pyridine-3-sulfonamide Formula: C22H21N5O5S MolecularWeight: 467.49764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CN=C(C=C4)CO)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CN=C(C=C4)CO)OC

InChI

InChI=1S/C22H21N5O5S/c1-31-16-9-15(10-17(11-16)32-2)24-21-22(26-20-6-4-3-5-19(20)25-21)27-33(29,30)18-8-7-14(13-28)23-12-18/h3-12,28H,13H2,1-2H3,(H,24,25)(H,26,27)