[4-(6-methylsulfanylpurin-9-yl)-2,3-bis(oxidanyl)cyclopentyl]methyl sulfamate

Systemtic Name: [4-(6-methylsulfanylpurin-9-yl)-2,3-bis(oxidanyl)cyclopentyl]methyl sulfamate Openeye Name: [2,3-dihydroxy-4-(6-methylsulfanylpurin-9-yl)cyclopentyl]methyl sulfamate CAS Name: sulfamic acid [2,3-dihydroxy-4-[6-(methylthio)-9-purinyl]cyclopentyl]methyl ester IUPAC Name: [2,3-dihydroxy-4-(6-methylsulfanylpurin-9-yl)cyclopentyl]methyl sulfamate Traditional Name: sulfamic acid [2,3-dihydroxy-4-[6-(methylthio)purin-9-yl]cyclopentyl]methyl ester Formula: C12H17N5O5S2 MolecularWeight: 375.42388

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=NC2=C1N=CN2C3CC(C(C3O)O)COS(=O)(=O)N

Isomeric SMILES

CSC1=NC=NC2=C1N=CN2C3CC(C(C3O)O)COS(=O)(=O)N

InChI

InChI=1S/C12H17N5O5S2/c1-23-12-8-11(14-4-15-12)17(5-16-8)7-2-6(9(18)10(7)19)3-22-24(13,20)21/h4-7,9-10,18-19H,2-3H2,1H3,(H2,13,20,21)