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S-[(3S)-3-cyano-2-oxidanylidene-3-pyridin-2-yl-propyl] ethanethioate

S-[(3S)-3-cyano-2-oxidanylidene-3-pyridin-2-yl-propyl] ethanethioate

Systemtic Name:S-[(3S)-3-cyano-2-oxidanylidene-3-pyridin-2-yl-propyl] ethanethioate
Openeye Name:S-[(3S)-3-cyano-2-oxo-3-(2-pyridyl)propyl] ethanethioate
CAS Name:ethanethioic acid S-[(3S)-3-cyano-2-oxo-3-(2-pyridinyl)propyl] ester
IUPAC Name:S-[(3S)-3-cyano-2-oxo-3-pyridin-2-ylpropyl] ethanethioate
Traditional Name:ethanethioic acid S-[(3S)-3-cyano-2-keto-3-(2-pyridyl)propyl] ester
Formula: C11H10N2O2S
MolecularWeight: 234.2743
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)C(C#N)C1=CC=CC=N1


Isomeric SMILES

CC(=O)SCC(=O)[C@H](C#N)C1=CC=CC=N1


InChI

InChI=1S/C11H10N2O2S/c1-8(14)16-7-11(15)9(6-12)10-4-2-3-5-13-10/h2-5,9H,7H2,1H3/t9-/m1/s1


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