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6-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]hexanoic acid

6-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]hexanoic acid

Systemtic Name:6-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]hexanoic acid
Openeye Name:6-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]hexanoic acid
CAS Name:6-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]hexanoic acid
IUPAC Name:6-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]hexanoic acid
Traditional Name:6-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]hexanoic acid
Formula: C13H20N2O3S
MolecularWeight: 284.3745
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCCCCCC(=O)O


Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCCCCCC(=O)O


InChI

InChI=1S/C13H20N2O3S/c1-2-6-10-9-11(16)15-13(14-10)19-8-5-3-4-7-12(17)18/h9H,2-8H2,1H3,(H,17,18)(H,14,15,16)


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