bis[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethyl] (4-methylsulfonylphenyl) phosphate

Systemtic Name: bis[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethyl] (4-methylsulfonylphenyl) phosphate Openeye Name: bis[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl] (4-methylsulfonylphenyl) phosphate CAS Name: phosphoric acid bis[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl] (4-methylsulfonylphenyl) ester IUPAC Name: bis[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl] (4-methylsulfonylphenyl) phosphate Traditional Name: phosphoric acid bis[2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethyl] (4-mesylphenyl) ester Formula: C23H27N10O10PS MolecularWeight: 666.560241

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)OP(=O)(OCCOCN2C=NC3=C2NC(=NC3=O)N)OCCOCN4C=NC5=C4NC(=NC5=O)N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)OP(=O)(OCCOCN2C=NC3=C2NC(=NC3=O)N)OCCOCN4C=NC5=C4NC(=NC5=O)N

InChI

InChI=1S/C23H27N10O10PS/c1-45(37,38)15-4-2-14(3-5-15)43-44(36,41-8-6-39-12-32-10-26-16-18(32)28-22(24)30-20(16)34)42-9-7-40-13-33-11-27-17-19(33)29-23(25)31-21(17)35/h2-5,10-11H,6-9,12-13H2,1H3,(H3,24,28,30,34)(H3,25,29,31,35)