3,3-bis(ethylsulfanyl)-2-[oxidanyl(pyridin-2-yl)methyl]prop-2-enenitrile

Systemtic Name: 3,3-bis(ethylsulfanyl)-2-[oxidanyl(pyridin-2-yl)methyl]prop-2-enenitrile Openeye Name: 3,3-bis(ethylsulfanyl)-2-[hydroxy(2-pyridyl)methyl]prop-2-enenitrile CAS Name: 3,3-bis(ethylthio)-2-[hydroxy(2-pyridinyl)methyl]-2-propenenitrile IUPAC Name: 3,3-bis(ethylsulfanyl)-2-[hydroxy(pyridin-2-yl)methyl]prop-2-enenitrile Traditional Name: 3,3-bis(ethylthio)-2-[hydroxy(2-pyridyl)methyl]acrylonitrile Formula: C13H16N2OS2 MolecularWeight: 280.40894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2OS2/c1-3-17-13(18-4-2)10(9-14)12(16)11-7-5-6-8-15-11/h5-8,12,16H,3-4H2,1-2H3