(2Z)-4,4-dimethyl-3-oxidanylidene-2-[phenylazanyl(sulfanyl)methylidene]pentanenitrile

Systemtic Name: (2Z)-4,4-dimethyl-3-oxidanylidene-2-[phenylazanyl(sulfanyl)methylidene]pentanenitrile Openeye Name: (2Z)-2-[anilino(sulfanyl)methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2Z)-2-[anilino(mercapto)methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: (2Z)-2-[anilino(sulfanyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: (Z)-3-anilino-3-mercapto-2-pivaloyl-acrylonitrile Formula: C14H16N2OS MolecularWeight: 260.35464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=C(NC1=CC=CC=C1)S)C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=C(/NC1=CC=CC=C1)\S)/C#N

InChI

InChI=1S/C14H16N2OS/c1-14(2,3)12(17)11(9-15)13(18)16-10-7-5-4-6-8-10/h4-8,16,18H,1-3H3/b13-11-