5-ethynyl-1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidine-2,4-dione

Systemtic Name: 5-ethynyl-1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidine-2,4-dione Openeye Name: 5-ethynyl-1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidine-2,4-dione CAS Name: 5-ethynyl-1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidine-2,4-dione IUPAC Name: 5-ethynyl-1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidine-2,4-dione Traditional Name: 5-ethynyl-1-[(2S,5R)-2-methylol-1,3-oxathiolan-5-yl]pyrimidine-2,4-quinone Formula: C10H10N2O4S MolecularWeight: 254.2624

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CN(C(=O)NC1=O)C2CSC(O2)CO

Isomeric SMILES

C#CC1=CN(C(=O)NC1=O)[C@H]2CS[C@H](O2)CO

InChI

InChI=1S/C10H10N2O4S/c1-2-6-3-12(10(15)11-9(6)14)7-5-17-8(4-13)16-7/h1,3,7-8,13H,4-5H2,(H,11,14,15)/t7-,8+/m1/s1