4-azanyl-5-ethynyl-1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one

Systemtic Name: 4-azanyl-5-ethynyl-1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one Openeye Name: 4-amino-5-ethynyl-1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one CAS Name: 4-amino-5-ethynyl-1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-pyrimidinone IUPAC Name: 4-amino-5-ethynyl-1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one Traditional Name: 4-amino-5-ethynyl-1-[(2S,5R)-2-methylol-1,3-oxathiolan-5-yl]pyrimidin-2-one Formula: C10H11N3O3S MolecularWeight: 253.27764

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CN(C(=O)N=C1N)C2CSC(O2)CO

Isomeric SMILES

C#CC1=CN(C(=O)N=C1N)[C@H]2CS[C@H](O2)CO

InChI

InChI=1S/C10H11N3O3S/c1-2-6-3-13(10(15)12-9(6)11)7-5-17-8(4-14)16-7/h1,3,7-8,14H,4-5H2,(H2,11,12,15)/t7-,8+/m1/s1