methyl 4-methyl-3-[[2-(trifluoromethyl)phenyl]carbamothioylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[[2-(trifluoromethyl)phenyl]carbamothioylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-(trifluoromethyl)phenyl]carbamothioylamino]benzoate CAS Name: 4-methyl-3-[[sulfanylidene-[2-(trifluoromethyl)anilino]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-(trifluoromethyl)phenyl]carbamothioylamino]benzoate Traditional Name: 4-methyl-3-[[2-(trifluoromethyl)phenyl]thiocarbamoylamino]benzoic acid methyl ester Formula: C17H15F3N2O2S MolecularWeight: 368.37341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=S)NC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=S)NC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C17H15F3N2O2S/c1-10-7-8-11(15(23)24-2)9-14(10)22-16(25)21-13-6-4-3-5-12(13)17(18,19)20/h3-9H,1-2H3,(H2,21,22,25)