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

Systemtic Name: 2-[[1-(2-hydroxyethyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-methyl-N-phenyl-ethanamide Openeye Name: 2-[[1-(2-hydroxyethyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-methyl-N-phenyl-acetamide CAS Name: 2-[[1-(2-hydroxyethyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-methyl-N-phenylacetamide IUPAC Name: 2-[[1-(2-hydroxyethyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-methyl-N-phenylacetamide Traditional Name: 2-[[1-(2-hydroxyethyl)-4-keto-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-methyl-N-phenyl-acetamide Formula: C16H17N5O3S MolecularWeight: 359.40288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N5O3S/c1-20(11-5-3-2-4-6-11)13(23)10-25-16-18-14-12(15(24)19-16)9-17-21(14)7-8-22/h2-6,9,17,22H,7-8,10H2,1H3