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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)N(CC3=CC=CC=C3C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)N(CC3=CC=CC=C3C)S(=O)(=O)C

InChI

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