cyanomethyl 2-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfanylbenzoate

Systemtic Name: cyanomethyl 2-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfanylbenzoate Openeye Name: cyanomethyl 2-(1,1-dioxothiolan-3-yl)sulfanylbenzoate CAS Name: 2-[(1,1-dioxo-3-thiolanyl)thio]benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(1,1-dioxothiolan-3-yl)sulfanylbenzoate Traditional Name: 2-[(1,1-diketothiolan-3-yl)thio]benzoic acid cyanomethyl ester Formula: C13H13NO4S2 MolecularWeight: 311.37662

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1SC2=CC=CC=C2C(=O)OCC#N

Isomeric SMILES

C1CS(=O)(=O)CC1SC2=CC=CC=C2C(=O)OCC#N

InChI

InChI=1S/C13H13NO4S2/c14-6-7-18-13(15)11-3-1-2-4-12(11)19-10-5-8-20(16,17)9-10/h1-4,10H,5,7-9H2