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

Systemtic Name: 6-[(3-chlorophenyl)methylsulfanyl]-1-(2-hydroxyethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(3-chlorophenyl)methylsulfanyl]-1-(2-hydroxyethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(3-chlorophenyl)methylthio]-1-(2-hydroxyethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(3-chlorophenyl)methylsulfanyl]-1-(2-hydroxyethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[(3-chlorobenzyl)thio]-1-(2-hydroxyethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C14H13ClN4O2S MolecularWeight: 336.79662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClN4O2S/c15-10-3-1-2-9(6-10)8-22-14-17-12-11(13(21)18-14)7-16-19(12)4-5-20/h1-3,6-7,16,20H,4-5,8H2