butyl 2-(6-oxidanyl-4-oxidanylidene-1-propyl-pyrimidin-2-yl)sulfanylethanoate

Systemtic Name: butyl 2-(6-oxidanyl-4-oxidanylidene-1-propyl-pyrimidin-2-yl)sulfanylethanoate Openeye Name: butyl 2-(6-hydroxy-4-oxo-1-propyl-pyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(6-hydroxy-4-oxo-1-propyl-2-pyrimidinyl)thio]acetic acid butyl ester IUPAC Name: butyl 2-(6-hydroxy-4-oxo-1-propylpyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(6-hydroxy-4-keto-1-propyl-pyrimidin-2-yl)thio]acetic acid butyl ester Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC(=O)C=C(N1CCC)O

Isomeric SMILES

CCCCOC(=O)CSC1=NC(=O)C=C(N1CCC)O

InChI

InChI=1S/C13H20N2O4S/c1-3-5-7-19-12(18)9-20-13-14-10(16)8-11(17)15(13)6-4-2/h8,17H,3-7,9H2,1-2H3