1-(phenylmethyl)-6-(phenylsulfonylmethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(phenylmethyl)-6-(phenylsulfonylmethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(benzenesulfonylmethyl)-1-benzyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(benzenesulfonylmethyl)-1-(phenylmethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-(benzenesulfonylmethyl)-1-benzyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-benzyl-6-(besylmethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H16N4O3S MolecularWeight: 380.42034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=NC(=NC(=O)C3=CN2)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=NC(=NC(=O)C3=CN2)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H16N4O3S/c24-19-16-11-20-23(12-14-7-3-1-4-8-14)18(16)21-17(22-19)13-27(25,26)15-9-5-2-6-10-15/h1-11,20H,12-13H2