4-(5H-purin-6-ylsulfanyldiazenyl)-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-(5H-purin-6-ylsulfanyldiazenyl)-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-(5H-purin-6-ylsulfanylazo)-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-(5H-purin-6-ylthio)azo-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-(5H-purin-6-ylsulfanyldiazenyl)-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-(5H-purin-6-ylthio)azo-N-(2-pyrimidyl)benzenesulfonamide Formula: C15H11N9O2S2 MolecularWeight: 413.43694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N=NSC3=NC=NC4=NC=NC43

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N=NSC3=NC=NC4=NC=NC43

InChI

InChI=1S/C15H11N9O2S2/c25-28(26,23-15-16-6-1-7-17-15)11-4-2-10(3-5-11)22-24-27-14-12-13(19-8-18-12)20-9-21-14/h1-9,12H,(H,16,17,23)