ethyl 3-[[2,4-bis(fluoranyl)phenyl]carbamothioylamino]benzoate

Systemtic Name: ethyl 3-[[2,4-bis(fluoranyl)phenyl]carbamothioylamino]benzoate Openeye Name: ethyl 3-[(2,4-difluorophenyl)carbamothioylamino]benzoate CAS Name: 3-[[(2,4-difluoroanilino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(2,4-difluorophenyl)carbamothioylamino]benzoate Traditional Name: 3-[(2,4-difluorophenyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C16H14F2N2O2S MolecularWeight: 336.356366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14F2N2O2S/c1-2-22-15(21)10-4-3-5-12(8-10)19-16(23)20-14-7-6-11(17)9-13(14)18/h3-9H,2H2,1H3,(H2,19,20,23)