6-[[(2R)-oxan-2-yl]methylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[[(2R)-oxan-2-yl]methylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-phenyl-6-[[(2R)-tetrahydropyran-2-yl]methylsulfanyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[[(2R)-2-oxanyl]methylthio]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[[(2R)-oxan-2-yl]methylsulfanyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-phenyl-6-[[(2R)-tetrahydropyran-2-yl]methylthio]-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

Isomeric SMILES

C1CCO[C@H](C1)CSC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

InChI

InChI=1S/C17H18N4O2S/c22-16-14-10-18-21(12-6-2-1-3-7-12)15(14)19-17(20-16)24-11-13-8-4-5-9-23-13/h1-3,6-7,10,13,18H,4-5,8-9,11H2/t13-/m1/s1