[3,3-dimethyl-2,4-bis(oxidanylidene)-5-thiocyanato-cyclohexyl] thiocyanate

Systemtic Name: [3,3-dimethyl-2,4-bis(oxidanylidene)-5-thiocyanato-cyclohexyl] thiocyanate Openeye Name: (3,3-dimethyl-2,4-dioxo-5-thiocyanato-cyclohexyl) thiocyanate CAS Name: thiocyanic acid (3,3-dimethyl-2,4-dioxo-5-thiocyanatocyclohexyl) ester IUPAC Name: (3,3-dimethyl-2,4-dioxo-5-thiocyanatocyclohexyl) thiocyanate Traditional Name: thiocyanic acid (2,4-diketo-3,3-dimethyl-5-thiocyanato-cyclohexyl) ester Formula: C10H10N2O2S2 MolecularWeight: 254.3286

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C(CC(C1=O)SC#N)SC#N)C

Isomeric SMILES

CC1(C(=O)C(CC(C1=O)SC#N)SC#N)C

InChI

InChI=1S/C10H10N2O2S2/c1-10(2)8(13)6(15-4-11)3-7(9(10)14)16-5-12/h6-7H,3H2,1-2H3