[1-acetamido-2,2,2-tris(chloranyl)ethyl] thiocyanate

Systemtic Name: [1-acetamido-2,2,2-tris(chloranyl)ethyl] thiocyanate Openeye Name: (1-acetamido-2,2,2-trichloro-ethyl) thiocyanate CAS Name: thiocyanic acid (1-acetamido-2,2,2-trichloroethyl) ester IUPAC Name: (1-acetamido-2,2,2-trichloroethyl) thiocyanate Traditional Name: thiocyanic acid (1-acetamido-2,2,2-trichloro-ethyl) ester Formula: C5H5Cl3N2OS MolecularWeight: 247.53

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(Cl)(Cl)Cl)SC#N

Isomeric SMILES

CC(=O)NC(C(Cl)(Cl)Cl)SC#N

InChI

InChI=1S/C5H5Cl3N2OS/c1-3(11)10-4(12-2-9)5(6,7)8/h4H,1H3,(H,10,11)