methyl [[(2S,5R)-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methoxy-phosphinothioyl]methanoate

Systemtic Name: methyl [[(2S,5R)-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methoxy-phosphinothioyl]methanoate Openeye Name: methyl [[(2S,5R)-5-(6-aminopurin-9-yl)tetrahydrofuran-2-yl]methoxy-methoxy-phosphinothioyl]formate CAS Name: [[(2S,5R)-5-(6-aminopurin-9-yl)-2-oxolanyl]methoxy-methoxyphosphinothioyl]formic acid methyl ester IUPAC Name: methyl [[(2S,5R)-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methoxyphosphinothioyl]formate Traditional Name: [[(2S,5R)-5-adenin-9-yltetrahydrofuran-2-yl]methoxy-methoxy-thiophosphoryl]formic acid methyl ester Formula: C13H18N5O5PS MolecularWeight: 387.351281

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)P(=S)(OC)OCC1CCC(O1)N2C=NC3=C2N=CN=C3N

Isomeric SMILES

COC(=O)P(=S)(OC)OC[C@@H]1CC[C@@H](O1)N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C13H18N5O5PS/c1-20-13(19)24(25,21-2)22-5-8-3-4-9(23-8)18-7-17-10-11(14)15-6-16-12(10)18/h6-9H,3-5H2,1-2H3,(H2,14,15,16)/t8-,9+,24?/m0/s1