2-ethanimidoyl-3-oxidanylidene-4-phenylsulfanyl-butanenitrile

Systemtic Name: 2-ethanimidoyl-3-oxidanylidene-4-phenylsulfanyl-butanenitrile Openeye Name: 2-ethanimidoyl-3-oxo-4-phenylsulfanyl-butanenitrile CAS Name: 2-(1-iminoethyl)-3-oxo-4-(phenylthio)butanenitrile IUPAC Name: 2-ethanimidoyl-3-oxo-4-phenylsulfanylbutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-(phenylthio)butyronitrile Formula: C12H12N2OS MolecularWeight: 232.30148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=CC=CC=C1

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=CC=CC=C1

InChI

InChI=1S/C12H12N2OS/c1-9(14)11(7-13)12(15)8-16-10-5-3-2-4-6-10/h2-6,11,14H,8H2,1H3