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2-[(3-cyano-4-methyl-6-oxidanylidene-1H-pyridin-2-yl)sulfanyl]ethanoic acid

2-[(3-cyano-4-methyl-6-oxidanylidene-1H-pyridin-2-yl)sulfanyl]ethanoic acid

Systemtic Name:2-[(3-cyano-4-methyl-6-oxidanylidene-1H-pyridin-2-yl)sulfanyl]ethanoic acid
Openeye Name:2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]acetic acid
CAS Name:2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)thio]acetic acid
IUPAC Name:2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]acetic acid
Traditional Name:2-[(3-cyano-6-keto-4-methyl-1H-pyridin-2-yl)thio]acetic acid
Formula: C9H8N2O3S
MolecularWeight: 224.23642
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)NC(=C1C#N)SCC(=O)O


Isomeric SMILES

CC1=CC(=O)NC(=C1C#N)SCC(=O)O


InChI

InChI=1S/C9H8N2O3S/c1-5-2-7(12)11-9(6(5)3-10)15-4-8(13)14/h2H,4H2,1H3,(H,11,12)(H,13,14)


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