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

Systemtic Name: 2-(4-chloranyl-2-methylsulfanyl-3-propylsulfanyl-phenyl)carbonyl-3-cyclopropyl-3-oxidanylidene-propanenitrile Openeye Name: 2-(4-chloro-2-methylsulfanyl-3-propylsulfanyl-benzoyl)-3-cyclopropyl-3-oxo-propanenitrile CAS Name: 2-[[4-chloro-2-(methylthio)-3-(propylthio)phenyl]-oxomethyl]-3-cyclopropyl-3-oxopropanenitrile IUPAC Name: 2-(4-chloro-2-methylsulfanyl-3-propylsulfanylbenzoyl)-3-cyclopropyl-3-oxopropanenitrile Traditional Name: 2-[4-chloro-2-(methylthio)-3-(propylthio)benzoyl]-3-cyclopropyl-3-keto-propionitrile Formula: C17H18ClNO2S2 MolecularWeight: 367.91332

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C=CC(=C1SC)C(=O)C(C#N)C(=O)C2CC2)Cl

Isomeric SMILES

CCCSC1=C(C=CC(=C1SC)C(=O)C(C#N)C(=O)C2CC2)Cl

InChI

InChI=1S/C17H18ClNO2S2/c1-3-8-23-17-13(18)7-6-11(16(17)22-2)15(21)12(9-19)14(20)10-4-5-10/h6-7,10,12H,3-5,8H2,1-2H3