[5-(6-aminopurin-9-yl)-3-azido-4-(4-methylphenyl)sulfonyloxy-oxolan-2-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [5-(6-aminopurin-9-yl)-3-azido-4-(4-methylphenyl)sulfonyloxy-oxolan-2-yl]methyl 4-methylbenzenesulfonate Openeye Name: [5-(6-aminopurin-9-yl)-3-azido-4-(p-tolylsulfonyloxy)tetrahydrofuran-2-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [5-(6-aminopurin-9-yl)-3-azido-4-(4-methylphenyl)sulfonyloxy-2-oxolanyl]methyl ester IUPAC Name: [5-(6-aminopurin-9-yl)-3-azido-4-(4-methylphenyl)sulfonyloxyoxolan-2-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (5-adenin-9-yl-3-azido-4-tosyloxy-tetrahydrofuran-2-yl)methyl ester Formula: C24H24N8O7S2 MolecularWeight: 600.62676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)OS(=O)(=O)C5=CC=C(C=C5)C)N=[N+]=[N-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)OS(=O)(=O)C5=CC=C(C=C5)C)N=[N+]=[N-]

InChI

InChI=1S/C24H24N8O7S2/c1-14-3-7-16(8-4-14)40(33,34)37-11-18-19(30-31-26)21(39-41(35,36)17-9-5-15(2)6-10-17)24(38-18)32-13-29-20-22(25)27-12-28-23(20)32/h3-10,12-13,18-19,21,24H,11H2,1-2H3,(H2,25,27,28)