4-(4-methylsulfanylpyrazolo[3,4-d]pyrimidin-1-yl)benzenesulfonamide

Systemtic Name: 4-(4-methylsulfanylpyrazolo[3,4-d]pyrimidin-1-yl)benzenesulfonamide Openeye Name: 4-(4-methylsulfanylpyrazolo[3,4-d]pyrimidin-1-yl)benzenesulfonamide CAS Name: 4-[4-(methylthio)-1-pyrazolo[3,4-d]pyrimidinyl]benzenesulfonamide IUPAC Name: 4-(4-methylsulfanylpyrazolo[3,4-d]pyrimidin-1-yl)benzenesulfonamide Traditional Name: 4-[4-(methylthio)pyrazolo[3,4-d]pyrimidin-1-yl]benzenesulfonamide Formula: C12H11N5O2S2 MolecularWeight: 321.37804

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=NC2=C1C=NN2C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CSC1=NC=NC2=C1C=NN2C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C12H11N5O2S2/c1-20-12-10-6-16-17(11(10)14-7-15-12)8-2-4-9(5-3-8)21(13,18)19/h2-7H,1H3,(H2,13,18,19)