ethyl N-[[2-(ethylsulfonylamino)-5-(trifluoromethyl)pyridin-3-yl]carbamothioyl]carbamate

Systemtic Name: ethyl N-[[2-(ethylsulfonylamino)-5-(trifluoromethyl)pyridin-3-yl]carbamothioyl]carbamate Openeye Name: ethyl N-[[2-(ethylsulfonylamino)-5-(trifluoromethyl)-3-pyridyl]carbamothioyl]carbamate CAS Name: N-[[[2-(ethylsulfonylamino)-5-(trifluoromethyl)-3-pyridinyl]amino]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[[2-(ethylsulfonylamino)-5-(trifluoromethyl)pyridin-3-yl]carbamothioyl]carbamate Traditional Name: N-[[2-(esylamino)-5-(trifluoromethyl)-3-pyridyl]thiocarbamoyl]carbamic acid ethyl ester Formula: C12H15F3N4O4S2 MolecularWeight: 400.39711

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)NC1=C(N=CC(=C1)C(F)(F)F)NS(=O)(=O)CC

Isomeric SMILES

CCOC(=O)NC(=S)NC1=C(N=CC(=C1)C(F)(F)F)NS(=O)(=O)CC

InChI

InChI=1S/C12H15F3N4O4S2/c1-3-23-11(20)18-10(24)17-8-5-7(12(13,14)15)6-16-9(8)19-25(21,22)4-2/h5-6H,3-4H2,1-2H3,(H,16,19)(H2,17,18,20,24)