methyl 2-[[2,4-bis(fluoranyl)phenyl]sulfanylcarbothioylamino]benzoate

Systemtic Name: methyl 2-[[2,4-bis(fluoranyl)phenyl]sulfanylcarbothioylamino]benzoate Openeye Name: methyl 2-[(2,4-difluorophenyl)sulfanylcarbothioylamino]benzoate CAS Name: 2-[[[(2,4-difluorophenyl)thio]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(2,4-difluorophenyl)sulfanylcarbothioylamino]benzoate Traditional Name: 2-[[(2,4-difluorophenyl)thio]carbothioylamino]benzoic acid methyl ester Formula: C15H11F2NO2S2 MolecularWeight: 339.380146

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=S)SC2=C(C=C(C=C2)F)F

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=S)SC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C15H11F2NO2S2/c1-20-14(19)10-4-2-3-5-12(10)18-15(21)22-13-7-6-9(16)8-11(13)17/h2-8H,1H3,(H,18,21)