N-(2,6-dimethoxy-7H-purin-8-yl)benzenesulfonamide

Systemtic Name: N-(2,6-dimethoxy-7H-purin-8-yl)benzenesulfonamide Openeye Name: N-(2,6-dimethoxy-7H-purin-8-yl)benzenesulfonamide CAS Name: N-(2,6-dimethoxy-7H-purin-8-yl)benzenesulfonamide IUPAC Name: N-(2,6-dimethoxy-7H-purin-8-yl)benzenesulfonamide Traditional Name: N-(2,6-dimethoxy-7H-purin-8-yl)benzenesulfonamide Formula: C13H13N5O4S MolecularWeight: 335.33842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC2=C1NC(=N2)NS(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=NC(=NC2=C1NC(=N2)NS(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C13H13N5O4S/c1-21-11-9-10(16-13(17-11)22-2)15-12(14-9)18-23(19,20)8-6-4-3-5-7-8/h3-7H,1-2H3,(H2,14,15,16,17,18)