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

Systemtic Name: 1-(2-hydroxyethyl)-6-(3-methylbutylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(2-hydroxyethyl)-6-isopentylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(2-hydroxyethyl)-6-(3-methylbutylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-(2-hydroxyethyl)-6-(3-methylbutylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(2-hydroxyethyl)-6-(isoamylthio)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C12H18N4O2S MolecularWeight: 282.36192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NC(=O)C2=CNN(C2=N1)CCO

Isomeric SMILES

CC(C)CCSC1=NC(=O)C2=CNN(C2=N1)CCO

InChI

InChI=1S/C12H18N4O2S/c1-8(2)3-6-19-12-14-10-9(11(18)15-12)7-13-16(10)4-5-17/h7-8,13,17H,3-6H2,1-2H3