[2-(4-methylsulfonylphenyl)-2-oxidanylidene-ethyl] thiocyanate

Systemtic Name: [2-(4-methylsulfonylphenyl)-2-oxidanylidene-ethyl] thiocyanate Openeye Name: [2-(4-methylsulfonylphenyl)-2-oxo-ethyl] thiocyanate CAS Name: thiocyanic acid [2-(4-methylsulfonylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfonylphenyl)-2-oxoethyl] thiocyanate Traditional Name: thiocyanic acid [2-keto-2-(4-mesylphenyl)ethyl] ester Formula: C10H9NO3S2 MolecularWeight: 255.31336

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)CSC#N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)CSC#N

InChI

InChI=1S/C10H9NO3S2/c1-16(13,14)9-4-2-8(3-5-9)10(12)6-15-7-11/h2-5H,6H2,1H3