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2-(1,3-dithiepan-2-ylidene)-3-oxidanylidene-3-[3-(trifluoromethyl)phenyl]propanenitrile

2-(1,3-dithiepan-2-ylidene)-3-oxidanylidene-3-[3-(trifluoromethyl)phenyl]propanenitrile

Systemtic Name:2-(1,3-dithiepan-2-ylidene)-3-oxidanylidene-3-[3-(trifluoromethyl)phenyl]propanenitrile
Openeye Name:2-(1,3-dithiepan-2-ylidene)-3-oxo-3-[3-(trifluoromethyl)phenyl]propanenitrile
CAS Name:2-(1,3-dithiepan-2-ylidene)-3-oxo-3-[3-(trifluoromethyl)phenyl]propanenitrile
IUPAC Name:2-(1,3-dithiepan-2-ylidene)-3-oxo-3-[3-(trifluoromethyl)phenyl]propanenitrile
Traditional Name:2-(1,3-dithiepan-2-ylidene)-3-keto-3-[3-(trifluoromethyl)phenyl]propionitrile
Formula: C15H12F3NOS2
MolecularWeight: 343.38709
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Descriptors Computed from Structure

Canonical SMILES:

C1CCSC(=C(C#N)C(=O)C2=CC(=CC=C2)C(F)(F)F)SC1


Isomeric SMILES

C1CCSC(=C(C#N)C(=O)C2=CC(=CC=C2)C(F)(F)F)SC1


InChI

InChI=1S/C15H12F3NOS2/c16-15(17,18)11-5-3-4-10(8-11)13(20)12(9-19)14-21-6-1-2-7-22-14/h3-5,8H,1-2,6-7H2


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