methyl 4-[2-[(3-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(3-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(3-chlorophenyl)methyl-(p-tolylsulfonyl)amino]acetyl]amino]benzoate CAS Name: 4-[[2-[(3-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(3-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[(3-chlorobenzyl)-tosyl-amino]acetyl]amino]benzoic acid methyl ester Formula: C24H23ClN2O5S MolecularWeight: 486.96782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC(=CC=C2)Cl)CC(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC(=CC=C2)Cl)CC(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C24H23ClN2O5S/c1-17-6-12-22(13-7-17)33(30,31)27(15-18-4-3-5-20(25)14-18)16-23(28)26-21-10-8-19(9-11-21)24(29)32-2/h3-14H,15-16H2,1-2H3,(H,26,28)