N'-(2-azanyl-2-sulfanylidene-ethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]ethanediamide

Systemtic Name: N'-(2-azanyl-2-sulfanylidene-ethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]ethanediamide Openeye Name: N'-(2-amino-2-thioxo-ethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]oxamide CAS Name: N'-(2-amino-2-sulfanylideneethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]oxamide IUPAC Name: N'-(2-amino-2-sulfanylideneethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]oxamide Traditional Name: N'-(2-amino-2-thioxo-ethyl)-N-[3-(trifluoromethyl)benzyl]oxamide Formula: C12H12F3N3O2S MolecularWeight: 319.30279

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)C(=O)NCC(=S)N

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)C(=O)NCC(=S)N

InChI

InChI=1S/C12H12F3N3O2S/c13-12(14,15)8-3-1-2-7(4-8)5-17-10(19)11(20)18-6-9(16)21/h1-4H,5-6H2,(H2,16,21)(H,17,19)(H,18,20)