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

Systemtic Name: ethyl 3-[2-[(2-ethylphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]-4-methyl-benzoate Openeye Name: ethyl 3-[[2-[2-ethyl-N-(p-tolylsulfonyl)anilino]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]amino]-4-methylbenzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(2-ethyl-N-tosyl-anilino)acetyl]amino]-4-methyl-benzoic acid ethyl ester Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(CC(=O)NC2=C(C=CC(=C2)C(=O)OCC)C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC=CC=C1N(CC(=O)NC2=C(C=CC(=C2)C(=O)OCC)C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C27H30N2O5S/c1-5-21-9-7-8-10-25(21)29(35(32,33)23-15-11-19(3)12-16-23)18-26(30)28-24-17-22(14-13-20(24)4)27(31)34-6-2/h7-17H,5-6,18H2,1-4H3,(H,28,30)