[5-(2-methylsulfanyl-6-sulfanylidene-3H-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate

Systemtic Name: [5-(2-methylsulfanyl-6-sulfanylidene-3H-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [3,4-dihydroxy-5-(2-methylsulfanyl-6-thioxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [3,4-dihydroxy-5-[2-(methylthio)-6-sulfanylidene-3H-purin-9-yl]-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [3,4-dihydroxy-5-(2-methylsulfanyl-6-sulfanylidene-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [3,4-dihydroxy-5-[2-(methylthio)-6-thioxo-3H-purin-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C11H15N4O7PS2 MolecularWeight: 410.363161

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=S)C2=C(N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O

Isomeric SMILES

CSC1=NC(=S)C2=C(N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O

InChI

InChI=1S/C11H15N4O7PS2/c1-25-11-13-8-5(9(24)14-11)12-3-15(8)10-7(17)6(16)4(22-10)2-21-23(18,19)20/h3-4,6-7,10,16-17H,2H2,1H3,(H,13,14,24)(H2,18,19,20)