5-butan-2-yl-1-[5-(hydroxymethyl)-4-oxidanyl-thiolan-2-yl]pyrimidine-2,4-dione

Systemtic Name: 5-butan-2-yl-1-[5-(hydroxymethyl)-4-oxidanyl-thiolan-2-yl]pyrimidine-2,4-dione Openeye Name: 1-[4-hydroxy-5-(hydroxymethyl)tetrahydrothiophen-2-yl]-5-sec-butyl-pyrimidine-2,4-dione CAS Name: 5-butan-2-yl-1-[4-hydroxy-5-(hydroxymethyl)-2-thiolanyl]pyrimidine-2,4-dione IUPAC Name: 5-butan-2-yl-1-[4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]pyrimidine-2,4-dione Traditional Name: 1-(4-hydroxy-5-methylol-tetrahydrothiophen-2-yl)-5-sec-butyl-pyrimidine-2,4-quinone Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CN(C(=O)NC1=O)C2CC(C(S2)CO)O

Isomeric SMILES

CCC(C)C1=CN(C(=O)NC1=O)C2CC(C(S2)CO)O

InChI

InChI=1S/C13H20N2O4S/c1-3-7(2)8-5-15(13(19)14-12(8)18)11-4-9(17)10(6-16)20-11/h5,7,9-11,16-17H,3-4,6H2,1-2H3,(H,14,18,19)