9-[(3S,5R)-5-(hydroxymethyl)-4-methylidene-thiolan-3-yl]-3H-purin-6-one

Systemtic Name: 9-[(3S,5R)-5-(hydroxymethyl)-4-methylidene-thiolan-3-yl]-3H-purin-6-one Openeye Name: 9-[(3S,5R)-5-(hydroxymethyl)-4-methylene-tetrahydrothiophen-3-yl]-3H-purin-6-one CAS Name: 9-[(3S,5R)-5-(hydroxymethyl)-4-methylene-3-thiolanyl]-3H-purin-6-one IUPAC Name: 9-[(3S,5R)-5-(hydroxymethyl)-4-methylidenethiolan-3-yl]-3H-purin-6-one Traditional Name: 9-[(3S,5R)-4-methylene-5-methylol-tetrahydrothiophen-3-yl]-3H-purin-6-one Formula: C11H12N4O2S MolecularWeight: 264.30358

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(CSC1CO)N2C=NC3=C2NC=NC3=O

Isomeric SMILES

C=C1[C@@H](CS[C@H]1CO)N2C=NC3=C2NC=NC3=O

InChI

InChI=1S/C11H12N4O2S/c1-6-7(3-18-8(6)2-16)15-5-14-9-10(15)12-4-13-11(9)17/h4-5,7-8,16H,1-3H2,(H,12,13,17)/t7-,8+/m1/s1