2-[2,5-bis(chloranyl)phenyl]sulfanylethanenitrile

Systemtic Name: 2-[2,5-bis(chloranyl)phenyl]sulfanylethanenitrile Openeye Name: 2-(2,5-dichlorophenyl)sulfanylacetonitrile CAS Name: 2-[(2,5-dichlorophenyl)thio]acetonitrile IUPAC Name: 2-(2,5-dichlorophenyl)sulfanylacetonitrile Traditional Name: 2-[(2,5-dichlorophenyl)thio]acetonitrile Formula: C8H5Cl2NS MolecularWeight: 218.103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)SCC#N)Cl

Isomeric SMILES

C1=CC(=C(C=C1Cl)SCC#N)Cl

InChI

InChI=1S/C8H5Cl2NS/c9-6-1-2-7(10)8(5-6)12-4-3-11/h1-2,5H,4H2