4-[2,5-bis(chloranyl)phenyl]sulfanyl-2-ethanimidoyl-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[2,5-bis(chloranyl)phenyl]sulfanyl-2-ethanimidoyl-3-oxidanylidene-butanenitrile Openeye Name: 4-(2,5-dichlorophenyl)sulfanyl-2-ethanimidoyl-3-oxo-butanenitrile CAS Name: 4-[(2,5-dichlorophenyl)thio]-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: 4-(2,5-dichlorophenyl)sulfanyl-2-ethanimidoyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-4-[(2,5-dichlorophenyl)thio]-3-keto-butyronitrile Formula: C12H10Cl2N2OS MolecularWeight: 301.1916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10Cl2N2OS/c1-7(16)9(5-15)11(17)6-18-12-4-8(13)2-3-10(12)14/h2-4,9,16H,6H2,1H3