2-(4-chloranyl-3-ethylsulfanyl-2-methylsulfanyl-phenyl)carbonyl-3-cyclopropyl-3-oxidanylidene-propanenitrile

Systemtic Name: 2-(4-chloranyl-3-ethylsulfanyl-2-methylsulfanyl-phenyl)carbonyl-3-cyclopropyl-3-oxidanylidene-propanenitrile Openeye Name: 2-(4-chloro-3-ethylsulfanyl-2-methylsulfanyl-benzoyl)-3-cyclopropyl-3-oxo-propanenitrile CAS Name: 2-[[4-chloro-3-(ethylthio)-2-(methylthio)phenyl]-oxomethyl]-3-cyclopropyl-3-oxopropanenitrile IUPAC Name: 2-(4-chloro-3-ethylsulfanyl-2-methylsulfanylbenzoyl)-3-cyclopropyl-3-oxopropanenitrile Traditional Name: 2-[4-chloro-3-(ethylthio)-2-(methylthio)benzoyl]-3-cyclopropyl-3-keto-propionitrile Formula: C16H16ClNO2S2 MolecularWeight: 353.88674

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=CC(=C1SC)C(=O)C(C#N)C(=O)C2CC2)Cl

Isomeric SMILES

CCSC1=C(C=CC(=C1SC)C(=O)C(C#N)C(=O)C2CC2)Cl

InChI

InChI=1S/C16H16ClNO2S2/c1-3-22-16-12(17)7-6-10(15(16)21-2)14(20)11(8-18)13(19)9-4-5-9/h6-7,9,11H,3-5H2,1-2H3