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

Systemtic Name: methyl 2-[2-[(4-fluorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[(4-fluorophenyl)methyl-(p-tolylsulfonyl)amino]acetyl]amino]benzoate CAS Name: 2-[[2-[(4-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[(4-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]acetyl]amino]benzoate Traditional Name: 2-[[2-[(4-fluorobenzyl)-tosyl-amino]acetyl]amino]benzoic acid methyl ester Formula: C24H23FN2O5S MolecularWeight: 470.513223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)F)CC(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)F)CC(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C24H23FN2O5S/c1-17-7-13-20(14-8-17)33(30,31)27(15-18-9-11-19(25)12-10-18)16-23(28)26-22-6-4-3-5-21(22)24(29)32-2/h3-14H,15-16H2,1-2H3,(H,26,28)