3-(4-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(4-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxidanylidene-propanenitrile Openeye Name: 3-(4-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxo-propanenitrile CAS Name: 3-(4-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxopropanenitrile IUPAC Name: 3-(4-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxopropanenitrile Traditional Name: 3-(4-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-keto-propionitrile Formula: C12H8ClNOS2 MolecularWeight: 281.78102

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=C(C#N)C(=O)C2=CC=C(C=C2)Cl)S1

Isomeric SMILES

C1CSC(=C(C#N)C(=O)C2=CC=C(C=C2)Cl)S1

InChI

InChI=1S/C12H8ClNOS2/c13-9-3-1-8(2-4-9)11(15)10(7-14)12-16-5-6-17-12/h1-4H,5-6H2