1-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-4,6-bis(methylsulfanyl)pyrazolo[3,4-d]pyrimidine-3-carbonitrile

Systemtic Name: 1-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-4,6-bis(methylsulfanyl)pyrazolo[3,4-d]pyrimidine-3-carbonitrile Openeye Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4,6-bis(methylsulfanyl)pyrazolo[3,4-d]pyrimidine-3-carbonitrile CAS Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-4,6-bis(methylthio)-3-pyrazolo[3,4-d]pyrimidinecarbonitrile IUPAC Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6-bis(methylsulfanyl)pyrazolo[3,4-d]pyrimidine-3-carbonitrile Traditional Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-4,6-bis(methylthio)pyrazolo[3,4-d]pyrimidine-3-carbonitrile Formula: C13H15N5O4S2 MolecularWeight: 369.4193

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC2=C1C(=NN2C3C(C(C(O3)CO)O)O)C#N)SC

Isomeric SMILES

CSC1=NC(=NC2=C1C(=NN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)C#N)SC

InChI

InChI=1S/C13H15N5O4S2/c1-23-11-7-5(3-14)17-18(10(7)15-13(16-11)24-2)12-9(21)8(20)6(4-19)22-12/h6,8-9,12,19-21H,4H2,1-2H3/t6-,8-,9-,12-/m1/s1