methyl 4-[2-[(5-fluoranyl-2-methoxy-phenyl)methylsulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(5-fluoranyl-2-methoxy-phenyl)methylsulfanyl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(5-fluoro-2-methoxy-phenyl)methylsulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(5-fluoro-2-methoxyphenyl)methylthio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(5-fluoro-2-methoxyphenyl)methylsulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(5-fluoro-2-methoxy-benzyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C18H18FNO4S MolecularWeight: 363.403223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)CSCC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)F)CSCC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H18FNO4S/c1-23-16-8-5-14(19)9-13(16)10-25-11-17(21)20-15-6-3-12(4-7-15)18(22)24-2/h3-9H,10-11H2,1-2H3,(H,20,21)