1-[(2R,3R,4R)-4-(hydroxymethyl)-3-oxidanyl-thietan-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(2R,3R,4R)-4-(hydroxymethyl)-3-oxidanyl-thietan-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[(2R,3R,4R)-3-hydroxy-4-(hydroxymethyl)thietan-2-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[(2R,3R,4R)-3-hydroxy-4-(hydroxymethyl)-2-thietanyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[(2R,3R,4R)-3-hydroxy-4-(hydroxymethyl)thietan-2-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[(2R,3R,4R)-3-hydroxy-4-methylol-thietan-2-yl]-5-methyl-pyrimidine-2,4-quinone Formula: C9H12N2O4S MolecularWeight: 244.26758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2C(C(S2)CO)O

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@H](S2)CO)O

InChI

InChI=1S/C9H12N2O4S/c1-4-2-11(9(15)10-7(4)14)8-6(13)5(3-12)16-8/h2,5-6,8,12-13H,3H2,1H3,(H,10,14,15)/t5-,6-,8-/m1/s1