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

Systemtic Name: ethyl 2-methyl-3-[[4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]phenyl]carbonylamino]benzoate Openeye Name: ethyl 2-methyl-3-[[4-[(3-methyl-N-methylsulfonyl-anilino)methyl]benzoyl]amino]benzoate CAS Name: 2-methyl-3-[[[4-[(3-methyl-N-methylsulfonylanilino)methyl]phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-methyl-3-[[4-[(3-methyl-N-methylsulfonylanilino)methyl]benzoyl]amino]benzoate Traditional Name: 3-[[4-[(N-mesyl-3-methyl-anilino)methyl]benzoyl]amino]-2-methyl-benzoic acid ethyl ester Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N2O5S/c1-5-33-26(30)23-10-7-11-24(19(23)3)27-25(29)21-14-12-20(13-15-21)17-28(34(4,31)32)22-9-6-8-18(2)16-22/h6-16H,5,17H2,1-4H3,(H,27,29)