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

Systemtic Name: 1-[2-(dimethylamino)-4-methylsulfonyl-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-[2-(dimethylamino)-4-methylsulfonyl-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-[2-(dimethylamino)-4-methylsulfonylphenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-[2-(dimethylamino)-4-methylsulfonylphenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-[2-(dimethylamino)-4-mesyl-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C14H15N5O3S MolecularWeight: 333.3656

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC(=C1)S(=O)(=O)C)N2C3=NC=NC(=O)C3=CN2

Isomeric SMILES

CN(C)C1=C(C=CC(=C1)S(=O)(=O)C)N2C3=NC=NC(=O)C3=CN2

InChI

InChI=1S/C14H15N5O3S/c1-18(2)12-6-9(23(3,21)22)4-5-11(12)19-13-10(7-17-19)14(20)16-8-15-13/h4-8,17H,1-3H3