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

Systemtic Name: methyl 4-methyl-3-[[4-[[methylsulfonyl(phenyl)amino]methyl]phenyl]carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[[4-[(N-methylsulfonylanilino)methyl]benzoyl]amino]benzoate CAS Name: 4-methyl-3-[[[4-[(N-methylsulfonylanilino)methyl]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[4-[(N-methylsulfonylanilino)methyl]benzoyl]amino]benzoate Traditional Name: 3-[[4-[(N-mesylanilino)methyl]benzoyl]amino]-4-methyl-benzoic acid methyl ester Formula: C24H24N2O5S MolecularWeight: 452.52276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)CN(C3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)CN(C3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C24H24N2O5S/c1-17-9-12-20(24(28)31-2)15-22(17)25-23(27)19-13-10-18(11-14-19)16-26(32(3,29)30)21-7-5-4-6-8-21/h4-15H,16H2,1-3H3,(H,25,27)