2-(1,3-dithiolan-2-ylidene)-2-(4-methylphenyl)sulfonyl-ethanenitrile

Systemtic Name: 2-(1,3-dithiolan-2-ylidene)-2-(4-methylphenyl)sulfonyl-ethanenitrile Openeye Name: 2-(1,3-dithiolan-2-ylidene)-2-(p-tolylsulfonyl)acetonitrile CAS Name: 2-(1,3-dithiolan-2-ylidene)-2-(4-methylphenyl)sulfonylacetonitrile IUPAC Name: 2-(1,3-dithiolan-2-ylidene)-2-(4-methylphenyl)sulfonylacetonitrile Traditional Name: 2-(1,3-dithiolan-2-ylidene)-2-tosyl-acetonitrile Formula: C12H11NO2S3 MolecularWeight: 297.41624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=C2SCCS2)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=C2SCCS2)C#N

InChI

InChI=1S/C12H11NO2S3/c1-9-2-4-10(5-3-9)18(14,15)11(8-13)12-16-6-7-17-12/h2-5H,6-7H2,1H3