2-azanyl-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-methylsulfinyl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-methylsulfinyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-methylsulfinyl-tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-methylsulfinyl-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-methylsulfinyloxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(2R,4S,5R)-5-methylol-4-methylsulfinyl-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C11H15N5O4S MolecularWeight: 313.3329

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1CC(OC1CO)N2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

CS(=O)[C@H]1C[C@@H](O[C@@H]1CO)N2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C11H15N5O4S/c1-21(19)6-2-7(20-5(6)3-17)16-4-13-8-9(16)14-11(12)15-10(8)18/h4-7,17H,2-3H2,1H3,(H3,12,14,15,18)/t5-,6+,7-,21?/m1/s1