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4-oxidanyl-3-[pyrazin-2-yl(sulfanyl)methyl]cyclohexane-1-carboxylic acid

4-oxidanyl-3-[pyrazin-2-yl(sulfanyl)methyl]cyclohexane-1-carboxylic acid

Systemtic Name:4-oxidanyl-3-[pyrazin-2-yl(sulfanyl)methyl]cyclohexane-1-carboxylic acid
Openeye Name:4-hydroxy-3-[pyrazin-2-yl(sulfanyl)methyl]cyclohexanecarboxylic acid
CAS Name:4-hydroxy-3-[mercapto(2-pyrazinyl)methyl]-1-cyclohexanecarboxylic acid
IUPAC Name:4-hydroxy-3-[pyrazin-2-yl(sulfanyl)methyl]cyclohexane-1-carboxylic acid
Traditional Name:4-hydroxy-3-[mercapto(pyrazin-2-yl)methyl]cyclohexanecarboxylic acid
Formula: C12H16N2O3S
MolecularWeight: 268.33204
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CC1C(=O)O)C(C2=NC=CN=C2)S)O


Isomeric SMILES

C1CC(C(CC1C(=O)O)C(C2=NC=CN=C2)S)O


InChI

InChI=1S/C12H16N2O3S/c15-10-2-1-7(12(16)17)5-8(10)11(18)9-6-13-3-4-14-9/h3-4,6-8,10-11,15,18H,1-2,5H2,(H,16,17)


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