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2-[(4-oxidanyl-6-oxidanylidene-5-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanoate

2-[(4-oxidanyl-6-oxidanylidene-5-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanoate

Systemtic Name:2-[(4-oxidanyl-6-oxidanylidene-5-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanoate
Openeye Name:2-[(4-hydroxy-6-oxo-5-propyl-1H-pyrimidin-2-yl)sulfanyl]acetate
CAS Name:2-[(4-hydroxy-6-oxo-5-propyl-1H-pyrimidin-2-yl)thio]acetate
IUPAC Name:2-[(4-hydroxy-6-oxo-5-propyl-1H-pyrimidin-2-yl)sulfanyl]acetate
Traditional Name:2-[(4-hydroxy-6-keto-5-propyl-1H-pyrimidin-2-yl)thio]acetate
Formula: C9H11N2O4S-
MolecularWeight: 243.25964
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C(NC1=O)SCC(=O)[O-])O


Isomeric SMILES

CCCC1=C(N=C(NC1=O)SCC(=O)[O-])O


InChI

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


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