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

Systemtic Name: methyl 3-[[4-[methylsulfonyl-(phenylmethyl)amino]phenyl]carbonylamino]benzoate Openeye Name: methyl 3-[[4-[benzyl(methylsulfonyl)amino]benzoyl]amino]benzoate CAS Name: 3-[[[4-[methylsulfonyl-(phenylmethyl)amino]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-[benzyl(methylsulfonyl)amino]benzoyl]amino]benzoate Traditional Name: 3-[[4-[benzyl(mesyl)amino]benzoyl]amino]benzoic acid methyl ester Formula: C23H22N2O5S MolecularWeight: 438.49618

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)N(CC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)N(CC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H22N2O5S/c1-30-23(27)19-9-6-10-20(15-19)24-22(26)18-11-13-21(14-12-18)25(31(2,28)29)16-17-7-4-3-5-8-17/h3-15H,16H2,1-2H3,(H,24,26)