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

Systemtic Name: methyl 2-methyl-3-[[4-[(4-methylphenyl)methyl-methylsulfonyl-amino]phenyl]carbonylamino]benzoate Openeye Name: methyl 2-methyl-3-[[4-[methylsulfonyl(p-tolylmethyl)amino]benzoyl]amino]benzoate CAS Name: 2-methyl-3-[[[4-[(4-methylphenyl)methyl-methylsulfonylamino]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-methyl-3-[[4-[(4-methylphenyl)methyl-methylsulfonylamino]benzoyl]amino]benzoate Traditional Name: 3-[[4-[mesyl-(4-methylbenzyl)amino]benzoyl]amino]-2-methyl-benzoic acid methyl ester Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3C)C(=O)OC)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3C)C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C25H26N2O5S/c1-17-8-10-19(11-9-17)16-27(33(4,30)31)21-14-12-20(13-15-21)24(28)26-23-7-5-6-22(18(23)2)25(29)32-3/h5-15H,16H2,1-4H3,(H,26,28)