ethyl 2-[4-[[3,5-bis(trifluoromethyl)phenyl]carbamothioylamino]phenoxy]propanoate

Systemtic Name: ethyl 2-[4-[[3,5-bis(trifluoromethyl)phenyl]carbamothioylamino]phenoxy]propanoate Openeye Name: ethyl 2-[4-[[3,5-bis(trifluoromethyl)phenyl]carbamothioylamino]phenoxy]propanoate CAS Name: 2-[4-[[[3,5-bis(trifluoromethyl)anilino]-sulfanylidenemethyl]amino]phenoxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[4-[[3,5-bis(trifluoromethyl)phenyl]carbamothioylamino]phenoxy]propanoate Traditional Name: 2-[4-[[3,5-bis(trifluoromethyl)phenyl]thiocarbamoylamino]phenoxy]propionic acid ethyl ester Formula: C20H18F6N2O3S MolecularWeight: 480.423939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC=C(C=C1)NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCOC(=O)C(C)OC1=CC=C(C=C1)NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C20H18F6N2O3S/c1-3-30-17(29)11(2)31-16-6-4-14(5-7-16)27-18(32)28-15-9-12(19(21,22)23)8-13(10-15)20(24,25)26/h4-11H,3H2,1-2H3,(H2,27,28,32)