methyl 4-[2-[(2,4-dimethylphenyl)-methylsulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(2,4-dimethylphenyl)-methylsulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(2,4-dimethyl-N-methylsulfonyl-anilino)acetyl]amino]benzoate CAS Name: 4-[[2-(2,4-dimethyl-N-methylsulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(2,4-dimethyl-N-methylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 4-[[2-(N-mesyl-2,4-dimethyl-anilino)acetyl]amino]benzoic acid methyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(CC(=O)NC2=CC=C(C=C2)C(=O)OC)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N(CC(=O)NC2=CC=C(C=C2)C(=O)OC)S(=O)(=O)C)C

InChI

InChI=1S/C19H22N2O5S/c1-13-5-10-17(14(2)11-13)21(27(4,24)25)12-18(22)20-16-8-6-15(7-9-16)19(23)26-3/h5-11H,12H2,1-4H3,(H,20,22)