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

Systemtic Name: (Z)-4-methyl-4-oxidanyl-3-pyridin-2-ylsulfanyl-hex-2-enenitrile Openeye Name: (Z)-4-hydroxy-4-methyl-3-(2-pyridylsulfanyl)hex-2-enenitrile CAS Name: (Z)-4-hydroxy-4-methyl-3-(2-pyridinylthio)-2-hexenenitrile IUPAC Name: (Z)-4-hydroxy-4-methyl-3-pyridin-2-ylsulfanylhex-2-enenitrile Traditional Name: (Z)-4-hydroxy-4-methyl-3-(2-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=CC=N1)O

Isomeric SMILES

CCC(C)(/C(=C/C#N)/SC1=CC=CC=N1)O

InChI

InChI=1S/C12H14N2OS/c1-3-12(2,15)10(7-8-13)16-11-6-4-5-9-14-11/h4-7,9,15H,3H2,1-2H3/b10-7-