2-(1,3-dithiolan-2-ylidene)-3-oxidanylidene-3-phenyl-propanenitrile

Systemtic Name: 2-(1,3-dithiolan-2-ylidene)-3-oxidanylidene-3-phenyl-propanenitrile Openeye Name: 2-(1,3-dithiolan-2-ylidene)-3-oxo-3-phenyl-propanenitrile CAS Name: 2-(1,3-dithiolan-2-ylidene)-3-oxo-3-phenylpropanenitrile IUPAC Name: 2-(1,3-dithiolan-2-ylidene)-3-oxo-3-phenylpropanenitrile Traditional Name: 2-(1,3-dithiolan-2-ylidene)-3-keto-3-phenyl-propionitrile Formula: C12H9NOS2 MolecularWeight: 247.33596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9NOS2/c13-8-10(12-15-6-7-16-12)11(14)9-4-2-1-3-5-9/h1-5H,6-7H2