methyl 5-[2-(4-ethoxyphenyl)sulfanylethanoylamino]-2,4-bis(fluoranyl)benzoate

Systemtic Name: methyl 5-[2-(4-ethoxyphenyl)sulfanylethanoylamino]-2,4-bis(fluoranyl)benzoate Openeye Name: methyl 5-[[2-(4-ethoxyphenyl)sulfanylacetyl]amino]-2,4-difluoro-benzoate CAS Name: 5-[[2-[(4-ethoxyphenyl)thio]-1-oxoethyl]amino]-2,4-difluorobenzoic acid methyl ester IUPAC Name: methyl 5-[[2-(4-ethoxyphenyl)sulfanylacetyl]amino]-2,4-difluorobenzoate Traditional Name: 2,4-difluoro-5-[[2-(p-phenetylthio)acetyl]amino]benzoic acid methyl ester Formula: C18H17F2NO4S MolecularWeight: 381.393686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)SCC(=O)NC2=C(C=C(C(=C2)C(=O)OC)F)F

Isomeric SMILES

CCOC1=CC=C(C=C1)SCC(=O)NC2=C(C=C(C(=C2)C(=O)OC)F)F

InChI

InChI=1S/C18H17F2NO4S/c1-3-25-11-4-6-12(7-5-11)26-10-17(22)21-16-8-13(18(23)24-2)14(19)9-15(16)20/h4-9H,3,10H2,1-2H3,(H,21,22)