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

Systemtic Name: 1-[2-(2-dimethylaminoethyloxy)-4-methylsulfonyl-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-[2-(2-dimethylaminoethyloxy)-4-methylsulfonyl-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-[2-(2-dimethylaminoethyloxy)-4-methylsulfonylphenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-[2-(2-dimethylaminoethyloxy)-4-methylsulfonylphenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-[2-(2-dimethylaminoethyloxy)-4-mesyl-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C16H19N5O4S MolecularWeight: 377.41816

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=C(C=CC(=C1)S(=O)(=O)C)N2C3=NC=NC(=O)C3=CN2

Isomeric SMILES

CN(C)CCOC1=C(C=CC(=C1)S(=O)(=O)C)N2C3=NC=NC(=O)C3=CN2

InChI

InChI=1S/C16H19N5O4S/c1-20(2)6-7-25-14-8-11(26(3,23)24)4-5-13(14)21-15-12(9-19-21)16(22)18-10-17-15/h4-5,8-10,19H,6-7H2,1-3H3