(2S)-3-[(4-ethylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-3-yl)methoxy]propane-1,2-diol

Systemtic Name: (2S)-3-[(4-ethylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-3-yl)methoxy]propane-1,2-diol Openeye Name: (2S)-3-[(4-ethylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-3-yl)methoxy]propane-1,2-diol CAS Name: (2S)-3-[[4-(ethylthio)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]methoxy]propane-1,2-diol IUPAC Name: (2S)-3-[(4-ethylsulfanyl-2H-pyrazolo[3,4-d]pyrimidin-3-yl)methoxy]propane-1,2-diol Traditional Name: (2S)-3-[[4-(ethylthio)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]methoxy]propane-1,2-diol Formula: C11H16N4O3S MolecularWeight: 284.33474

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=NC2=NNC(=C21)COCC(CO)O

Isomeric SMILES

CCSC1=NC=NC2=NNC(=C21)COC[C@H](CO)O

InChI

InChI=1S/C11H16N4O3S/c1-2-19-11-9-8(5-18-4-7(17)3-16)14-15-10(9)12-6-13-11/h6-7,16-17H,2-5H2,1H3,(H,12,13,14,15)/t7-/m0/s1