2-chloranyl-4-methoxy-N-methyl-5-(2-oxidanylidene-3,7-dihydropurin-8-yl)benzenesulfonamide

Systemtic Name: 2-chloranyl-4-methoxy-N-methyl-5-(2-oxidanylidene-3,7-dihydropurin-8-yl)benzenesulfonamide Openeye Name: 2-chloro-4-methoxy-N-methyl-5-(2-oxo-3,7-dihydropurin-8-yl)benzenesulfonamide CAS Name: 2-chloro-4-methoxy-N-methyl-5-(2-oxo-3,7-dihydropurin-8-yl)benzenesulfonamide IUPAC Name: 2-chloro-4-methoxy-N-methyl-5-(2-oxo-3,7-dihydropurin-8-yl)benzenesulfonamide Traditional Name: 2-chloro-5-(2-keto-3,7-dihydropurin-8-yl)-4-methoxy-N-methyl-benzenesulfonamide Formula: C13H12ClN5O4S MolecularWeight: 369.78348

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=C(C=C(C(=C1)C2=NC3=C(N2)C=NC(=O)N3)OC)Cl

Isomeric SMILES

CNS(=O)(=O)C1=C(C=C(C(=C1)C2=NC3=C(N2)C=NC(=O)N3)OC)Cl

InChI

InChI=1S/C13H12ClN5O4S/c1-15-24(21,22)10-3-6(9(23-2)4-7(10)14)11-17-8-5-16-13(20)19-12(8)18-11/h3-5,15H,1-2H3,(H2,16,17,18,19,20)