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

Systemtic Name: methyl 2-[2-[(2-fluorophenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[2-fluoro-N-(p-tolylsulfonyl)anilino]acetyl]amino]benzoate CAS Name: 2-[[2-(2-fluoro-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(2-fluoro-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]benzoate Traditional Name: 2-[[2-(2-fluoro-N-tosyl-anilino)acetyl]amino]benzoic acid methyl ester Formula: C23H21FN2O5S MolecularWeight: 456.486643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC=C2C(=O)OC)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC=C2C(=O)OC)C3=CC=CC=C3F

InChI

InChI=1S/C23H21FN2O5S/c1-16-11-13-17(14-12-16)32(29,30)26(21-10-6-4-8-19(21)24)15-22(27)25-20-9-5-3-7-18(20)23(28)31-2/h3-14H,15H2,1-2H3,(H,25,27)