5-(6-aminopurin-9-yl)-N-methyl-3,4-bis(oxidanyl)thiolane-2-carboxamide

Systemtic Name: 5-(6-aminopurin-9-yl)-N-methyl-3,4-bis(oxidanyl)thiolane-2-carboxamide Openeye Name: 5-(6-aminopurin-9-yl)-3,4-dihydroxy-N-methyl-tetrahydrothiophene-2-carboxamide CAS Name: 5-(6-aminopurin-9-yl)-3,4-dihydroxy-N-methyl-2-thiolanecarboxamide IUPAC Name: 5-(6-aminopurin-9-yl)-3,4-dihydroxy-N-methylthiolane-2-carboxamide Traditional Name: 5-adenin-9-yl-3,4-dihydroxy-N-methyl-tetrahydrothiophene-2-carboxamide Formula: C11H14N6O3S MolecularWeight: 310.33226

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1C(C(C(S1)N2C=NC3=C2N=CN=C3N)O)O

Isomeric SMILES

CNC(=O)C1C(C(C(S1)N2C=NC3=C2N=CN=C3N)O)O

InChI

InChI=1S/C11H14N6O3S/c1-13-10(20)7-5(18)6(19)11(21-7)17-3-16-4-8(12)14-2-15-9(4)17/h2-3,5-7,11,18-19H,1H3,(H,13,20)(H2,12,14,15)