methyl 3-methyl-4-[[2-[(2-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]amino]benzoate

Systemtic Name: methyl 3-methyl-4-[[2-[(2-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]amino]benzoate Openeye Name: methyl 3-methyl-4-[[2-(2-methylsulfonylanilino)-2-oxo-ethyl]amino]benzoate CAS Name: 3-methyl-4-[[2-(2-methylsulfonylanilino)-2-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-methyl-4-[[2-(2-methylsulfonylanilino)-2-oxoethyl]amino]benzoate Traditional Name: 4-[[2-keto-2-(2-mesylanilino)ethyl]amino]-3-methyl-benzoic acid methyl ester Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)NCC(=O)NC2=CC=CC=C2S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)NCC(=O)NC2=CC=CC=C2S(=O)(=O)C

InChI

InChI=1S/C18H20N2O5S/c1-12-10-13(18(22)25-2)8-9-14(12)19-11-17(21)20-15-6-4-5-7-16(15)26(3,23)24/h4-10,19H,11H2,1-3H3,(H,20,21)