methyl 2,4-bis(fluoranyl)-5-(3-phenylsulfanylpropanoylamino)benzoate

Systemtic Name: methyl 2,4-bis(fluoranyl)-5-(3-phenylsulfanylpropanoylamino)benzoate Openeye Name: methyl 2,4-difluoro-5-(3-phenylsulfanylpropanoylamino)benzoate CAS Name: 2,4-difluoro-5-[[1-oxo-3-(phenylthio)propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2,4-difluoro-5-(3-phenylsulfanylpropanoylamino)benzoate Traditional Name: 2,4-difluoro-5-[3-(phenylthio)propanoylamino]benzoic acid methyl ester Formula: C17H15F2NO3S MolecularWeight: 351.367706

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)CCSC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)CCSC2=CC=CC=C2

InChI

InChI=1S/C17H15F2NO3S/c1-23-17(22)12-9-15(14(19)10-13(12)18)20-16(21)7-8-24-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3,(H,20,21)