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methyl 4-[2-[3-(trifluoromethyl)phenyl]ethylcarbamothioylamino]benzoate
methyl 4-[2-[3-(trifluoromethyl)phenyl]ethylcarbamothioylamino]benzoate
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Descriptors Computed from Structure
Canonical SMILES:
COC(=O)C1=CC=C(C=C1)NC(=S)NCCC2=CC(=CC=C2)C(F)(F)F
Isomeric SMILES
COC(=O)C1=CC=C(C=C1)NC(=S)NCCC2=CC(=CC=C2)C(F)(F)F
InChI
InChI=1S/C18H17F3N2O2S/c1-25-16(24)13-5-7-15(8-6-13)23-17(26)22-10-9-12-3-2-4-14(11-12)18(19,20)21/h2-8,11H,9-10H2,1H3,(H2,22,23,26)
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