2-[[1-(2-hydroxyethyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-propyl-ethanamide

Systemtic Name: 2-[[1-(2-hydroxyethyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-propyl-ethanamide Openeye Name: 2-[[1-(2-hydroxyethyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-propyl-acetamide CAS Name: 2-[[1-(2-hydroxyethyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-propylacetamide IUPAC Name: 2-[[1-(2-hydroxyethyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-propylacetamide Traditional Name: 2-[[1-(2-hydroxyethyl)-4-keto-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-propyl-acetamide Formula: C12H17N5O3S MolecularWeight: 311.36008

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NC(=O)C2=CNN(C2=N1)CCO

Isomeric SMILES

CCCNC(=O)CSC1=NC(=O)C2=CNN(C2=N1)CCO

InChI

InChI=1S/C12H17N5O3S/c1-2-3-13-9(19)7-21-12-15-10-8(11(20)16-12)6-14-17(10)4-5-18/h6,14,18H,2-5,7H2,1H3,(H,13,19)