ethyl 4-[2-[(3-methylphenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(3-methylphenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[m-tolylmethyl(p-tolylsulfonyl)amino]acetyl]amino]benzoate CAS Name: 4-[[2-[(3-methylphenyl)methyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(3-methylphenyl)methyl-(4-methylphenyl)sulfonylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[(3-methylbenzyl)-tosyl-amino]acetyl]amino]benzoic acid ethyl ester Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(CC2=CC=CC(=C2)C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(CC2=CC=CC(=C2)C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H28N2O5S/c1-4-33-26(30)22-10-12-23(13-11-22)27-25(29)18-28(17-21-7-5-6-20(3)16-21)34(31,32)24-14-8-19(2)9-15-24/h5-16H,4,17-18H2,1-3H3,(H,27,29)