3,6-bis(methylsulfonyl)-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 3,6-bis(methylsulfonyl)-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 3,6-bis(methylsulfonyl)-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 3,6-bis(methylsulfonyl)-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 3,6-bis(methylsulfonyl)-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 3,6-dimesyl-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C13H12N4O5S2 MolecularWeight: 368.38818

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C2C(=NC(=NC2=O)S(=O)(=O)C)N(N1)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=C2C(=NC(=NC2=O)S(=O)(=O)C)N(N1)C3=CC=CC=C3

InChI

InChI=1S/C13H12N4O5S2/c1-23(19,20)12-9-10(14-13(15-11(9)18)24(2,21)22)17(16-12)8-6-4-3-5-7-8/h3-7,16H,1-2H3