2-methylsulfonylethyl N-(9-methyl-6-oxidanylidene-3H-purin-2-yl)carbamate

Systemtic Name: 2-methylsulfonylethyl N-(9-methyl-6-oxidanylidene-3H-purin-2-yl)carbamate Openeye Name: 2-methylsulfonylethyl N-(9-methyl-6-oxo-3H-purin-2-yl)carbamate CAS Name: N-(9-methyl-6-oxo-3H-purin-2-yl)carbamic acid 2-methylsulfonylethyl ester IUPAC Name: 2-methylsulfonylethyl N-(9-methyl-6-oxo-3H-purin-2-yl)carbamate Traditional Name: N-(6-keto-9-methyl-3H-purin-2-yl)carbamic acid 2-mesylethyl ester Formula: C10H13N5O5S MolecularWeight: 315.30572

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1NC(=NC2=O)NC(=O)OCCS(=O)(=O)C

Isomeric SMILES

CN1C=NC2=C1NC(=NC2=O)NC(=O)OCCS(=O)(=O)C

InChI

InChI=1S/C10H13N5O5S/c1-15-5-11-6-7(15)12-9(13-8(6)16)14-10(17)20-3-4-21(2,18)19/h5H,3-4H2,1-2H3,(H2,12,13,14,16,17)