methyl 2-chloranyl-5-[2-[(2-fluorophenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 2-chloranyl-5-[2-[(2-fluorophenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 2-chloro-5-[[2-[2-fluoro-N-(p-tolylsulfonyl)anilino]acetyl]amino]benzoate CAS Name: 2-chloro-5-[[2-(2-fluoro-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[[2-(2-fluoro-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]benzoate Traditional Name: 2-chloro-5-[[2-(2-fluoro-N-tosyl-anilino)acetyl]amino]benzoic acid methyl ester Formula: C23H20ClFN2O5S MolecularWeight: 490.931703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC(=C(C=C2)Cl)C(=O)OC)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC(=C(C=C2)Cl)C(=O)OC)C3=CC=CC=C3F

InChI

InChI=1S/C23H20ClFN2O5S/c1-15-7-10-17(11-8-15)33(30,31)27(21-6-4-3-5-20(21)25)14-22(28)26-16-9-12-19(24)18(13-16)23(29)32-2/h3-13H,14H2,1-2H3,(H,26,28)