methyl 2-[2-[3,4-bis(fluoranyl)phenyl]sulfanylethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[3,4-bis(fluoranyl)phenyl]sulfanylethanoylamino]benzoate Openeye Name: methyl 2-[[2-(3,4-difluorophenyl)sulfanylacetyl]amino]benzoate CAS Name: 2-[[2-[(3,4-difluorophenyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(3,4-difluorophenyl)sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[(3,4-difluorophenyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C16H13F2NO3S MolecularWeight: 337.341126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CSC2=CC(=C(C=C2)F)F

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CSC2=CC(=C(C=C2)F)F

InChI

InChI=1S/C16H13F2NO3S/c1-22-16(21)11-4-2-3-5-14(11)19-15(20)9-23-10-6-7-12(17)13(18)8-10/h2-8H,9H2,1H3,(H,19,20)