2-[1-(4-oxidanylbutyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylbutanamide

Systemtic Name: 2-[1-(4-oxidanylbutyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylbutanamide Openeye Name: 2-[1-(4-hydroxybutyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylbutanamide CAS Name: 2-[[1-(4-hydroxybutyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]butanamide IUPAC Name: 2-[1-(4-hydroxybutyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylbutanamide Traditional Name: 2-[[1-(4-hydroxybutyl)pyrazolo[3,4-d]pyrimidin-4-yl]thio]butyramide Formula: C13H19N5O2S MolecularWeight: 309.38726

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N)SC1=NC=NC2=C1C=NN2CCCCO

Isomeric SMILES

CCC(C(=O)N)SC1=NC=NC2=C1C=NN2CCCCO

InChI

InChI=1S/C13H19N5O2S/c1-2-10(11(14)20)21-13-9-7-17-18(5-3-4-6-19)12(9)15-8-16-13/h7-8,10,19H,2-6H2,1H3,(H2,14,20)