[5-(6-aminopurin-9-yl)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-methylsulfonyloxy-oxolan-3-yl] methanesulfonate

Systemtic Name: [5-(6-aminopurin-9-yl)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-methylsulfonyloxy-oxolan-3-yl] methanesulfonate Openeye Name: [5-(6-aminopurin-9-yl)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-methylsulfonyloxy-tetrahydrofuran-3-yl] methanesulfonate CAS Name: methanesulfonic acid [5-(6-aminopurin-9-yl)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-methylsulfonyloxy-3-oxolanyl] ester IUPAC Name: [5-(6-aminopurin-9-yl)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-methylsulfonyloxyoxolan-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [5-adenin-9-yl-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-methylsulfonyloxy-tetrahydrofuran-3-yl] ester Formula: C33H35N5O10S2 MolecularWeight: 725.7885

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4C(C(C(O4)N5C=NC6=C5N=CN=C6N)OS(=O)(=O)C)OS(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4C(C(C(O4)N5C=NC6=C5N=CN=C6N)OS(=O)(=O)C)OS(=O)(=O)C

InChI

InChI=1S/C33H35N5O10S2/c1-43-24-14-10-22(11-15-24)33(21-8-6-5-7-9-21,23-12-16-25(44-2)17-13-23)45-18-26-28(47-49(3,39)40)29(48-50(4,41)42)32(46-26)38-20-37-27-30(34)35-19-36-31(27)38/h5-17,19-20,26,28-29,32H,18H2,1-4H3,(H2,34,35,36)