methyl 4-chloranyl-3-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethanoylamino]benzoate Openeye Name: methyl 4-chloro-3-[[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]acetyl]amino]benzoate CAS Name: 4-chloro-3-[[2-[(2-chloro-6-fluorophenyl)methylthio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]acetyl]amino]benzoate Traditional Name: 4-chloro-3-[[2-[(2-chloro-6-fluoro-benzyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C17H14Cl2FNO3S MolecularWeight: 402.267363

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CSCC2=C(C=CC=C2Cl)F

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CSCC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C17H14Cl2FNO3S/c1-24-17(23)10-5-6-13(19)15(7-10)21-16(22)9-25-8-11-12(18)3-2-4-14(11)20/h2-7H,8-9H2,1H3,(H,21,22)