2-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-phenyl-ethanenitrile

Systemtic Name: 2-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-phenyl-ethanenitrile Openeye Name: 2-(1,1-dioxothiolan-3-yl)-2-phenyl-acetonitrile CAS Name: 2-(1,1-dioxo-3-thiolanyl)-2-phenylacetonitrile IUPAC Name: 2-(1,1-dioxothiolan-3-yl)-2-phenylacetonitrile Traditional Name: 2-(1,1-diketothiolan-3-yl)-2-phenyl-acetonitrile Formula: C12H13NO2S MolecularWeight: 235.30212

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1C(C#N)C2=CC=CC=C2

Isomeric SMILES

C1CS(=O)(=O)CC1C(C#N)C2=CC=CC=C2

InChI

InChI=1S/C12H13NO2S/c13-8-12(10-4-2-1-3-5-10)11-6-7-16(14,15)9-11/h1-5,11-12H,6-7,9H2