2-[(6-aminopurin-9-yl)methyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-3,4-diol

Systemtic Name: 2-[(6-aminopurin-9-yl)methyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-3,4-diol Openeye Name: 2-[(6-aminopurin-9-yl)methyl]-1-(p-tolylsulfonyl)pyrrolidine-3,4-diol CAS Name: 2-[(6-aminopurin-9-yl)methyl]-1-(4-methylphenyl)sulfonylpyrrolidine-3,4-diol IUPAC Name: 2-[(6-aminopurin-9-yl)methyl]-1-(4-methylphenyl)sulfonylpyrrolidine-3,4-diol Traditional Name: 2-(adenin-9-ylmethyl)-1-tosyl-pyrrolidine-3,4-diol Formula: C17H20N6O4S MolecularWeight: 404.4435

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C(C2CN3C=NC4=C3N=CN=C4N)O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C(C2CN3C=NC4=C3N=CN=C4N)O)O

InChI

InChI=1S/C17H20N6O4S/c1-10-2-4-11(5-3-10)28(26,27)23-7-13(24)15(25)12(23)6-22-9-21-14-16(18)19-8-20-17(14)22/h2-5,8-9,12-13,15,24-25H,6-7H2,1H3,(H2,18,19,20)