(Z)-4-methyl-4-oxidanyl-3-pyridin-4-ylsulfanyl-hex-2-enenitrile

Systemtic Name: (Z)-4-methyl-4-oxidanyl-3-pyridin-4-ylsulfanyl-hex-2-enenitrile Openeye Name: (Z)-4-hydroxy-4-methyl-3-(4-pyridylsulfanyl)hex-2-enenitrile CAS Name: (Z)-4-hydroxy-4-methyl-3-(pyridin-4-ylthio)-2-hexenenitrile IUPAC Name: (Z)-4-hydroxy-4-methyl-3-pyridin-4-ylsulfanylhex-2-enenitrile Traditional Name: (Z)-4-hydroxy-4-methyl-3-(4-pyridylthio)hex-2-enenitrile Formula: C12H14N2OS MolecularWeight: 234.31736

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=CC#N)SC1=CC=NC=C1)O

Isomeric SMILES

CCC(C)(/C(=C/C#N)/SC1=CC=NC=C1)O

InChI

InChI=1S/C12H14N2OS/c1-3-12(2,15)11(4-7-13)16-10-5-8-14-9-6-10/h4-6,8-9,15H,3H2,1-2H3/b11-4-