ethyl 4-[[3-(trifluoromethyl)phenyl]carbamothioyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[3-(trifluoromethyl)phenyl]carbamothioyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[3-(trifluoromethyl)phenyl]carbamothioyl]piperazine-1-carboxylate CAS Name: 4-[sulfanylidene-[3-(trifluoromethyl)anilino]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-(trifluoromethyl)phenyl]carbamothioyl]piperazine-1-carboxylate Traditional Name: 4-[[3-(trifluoromethyl)phenyl]thiocarbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C15H18F3N3O2S MolecularWeight: 361.38253

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C15H18F3N3O2S/c1-2-23-14(22)21-8-6-20(7-9-21)13(24)19-12-5-3-4-11(10-12)15(16,17)18/h3-5,10H,2,6-9H2,1H3,(H,19,24)