(2Z)-3-oxidanylidene-2-[oxidanyl(phenylsulfanyl)methylidene]butanenitrile

Systemtic Name: (2Z)-3-oxidanylidene-2-[oxidanyl(phenylsulfanyl)methylidene]butanenitrile Openeye Name: (2Z)-2-[hydroxy(phenylsulfanyl)methylene]-3-oxo-butanenitrile CAS Name: (2Z)-2-[hydroxy-(phenylthio)methylidene]-3-oxobutanenitrile IUPAC Name: (2Z)-2-[hydroxy(phenylsulfanyl)methylidene]-3-oxobutanenitrile Traditional Name: (Z)-2-acetyl-3-hydroxy-3-(phenylthio)acrylonitrile Formula: C11H9NO2S MolecularWeight: 219.25966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)/C(=C(/O)\SC1=CC=CC=C1)/C#N

InChI

InChI=1S/C11H9NO2S/c1-8(13)10(7-12)11(14)15-9-5-3-2-4-6-9/h2-6,14H,1H3/b11-10-