methyl 3-[[2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]phenyl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]phenyl]carbonylamino]benzoate Openeye Name: methyl 3-[[2-[benzyl(p-tolylsulfonyl)amino]benzoyl]amino]benzoate CAS Name: 3-[[[2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-[benzyl-(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate Traditional Name: 3-[[2-[benzyl(tosyl)amino]benzoyl]amino]benzoic acid methyl ester Formula: C29H26N2O5S MolecularWeight: 514.59214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)NC4=CC=CC(=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)NC4=CC=CC(=C4)C(=O)OC

InChI

InChI=1S/C29H26N2O5S/c1-21-15-17-25(18-16-21)37(34,35)31(20-22-9-4-3-5-10-22)27-14-7-6-13-26(27)28(32)30-24-12-8-11-23(19-24)29(33)36-2/h3-19H,20H2,1-2H3,(H,30,32)