S-[2-(4-cyanophenyl)carbonyl-4-(trifluoromethyl)phenyl] N,N-dimethylcarbamothioate

Systemtic Name: S-[2-(4-cyanophenyl)carbonyl-4-(trifluoromethyl)phenyl] N,N-dimethylcarbamothioate Openeye Name: S-[2-(4-cyanobenzoyl)-4-(trifluoromethyl)phenyl] N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid S-[2-[(4-cyanophenyl)-oxomethyl]-4-(trifluoromethyl)phenyl] ester IUPAC Name: S-[2-(4-cyanobenzoyl)-4-(trifluoromethyl)phenyl] N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid S-[2-(4-cyanobenzoyl)-4-(trifluoromethyl)phenyl] ester Formula: C18H13F3N2O2S MolecularWeight: 378.36823

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)SC1=C(C=C(C=C1)C(F)(F)F)C(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CN(C)C(=O)SC1=C(C=C(C=C1)C(F)(F)F)C(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H13F3N2O2S/c1-23(2)17(25)26-15-8-7-13(18(19,20)21)9-14(15)16(24)12-5-3-11(10-22)4-6-12/h3-9H,1-2H3