6-[(3,5-dimethoxyphenyl)methylsulfanyl]-1-(2-hydroxyethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[(3,5-dimethoxyphenyl)methylsulfanyl]-1-(2-hydroxyethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(3,5-dimethoxyphenyl)methylsulfanyl]-1-(2-hydroxyethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(3,5-dimethoxyphenyl)methylthio]-1-(2-hydroxyethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(3,5-dimethoxyphenyl)methylsulfanyl]-1-(2-hydroxyethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[(3,5-dimethoxybenzyl)thio]-1-(2-hydroxyethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C16H18N4O4S MolecularWeight: 362.40352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CSC2=NC(=O)C3=CNN(C3=N2)CCO)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CSC2=NC(=O)C3=CNN(C3=N2)CCO)OC

InChI

InChI=1S/C16H18N4O4S/c1-23-11-5-10(6-12(7-11)24-2)9-25-16-18-14-13(15(22)19-16)8-17-20(14)3-4-21/h5-8,17,21H,3-4,9H2,1-2H3