ethyl 3-[2-[(4-ethylphenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-[(4-ethylphenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-[N-(benzenesulfonyl)-4-ethyl-anilino]acetyl]amino]benzoate CAS Name: 3-[[2-[N-(benzenesulfonyl)-4-ethylanilino]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[N-(benzenesulfonyl)-4-ethylanilino]acetyl]amino]benzoate Traditional Name: 3-[[2-(N-besyl-4-ethyl-anilino)acetyl]amino]benzoic acid ethyl ester Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC(=C2)C(=O)OCC)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC(=C2)C(=O)OCC)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H26N2O5S/c1-3-19-13-15-22(16-14-19)27(33(30,31)23-11-6-5-7-12-23)18-24(28)26-21-10-8-9-20(17-21)25(29)32-4-2/h5-17H,3-4,18H2,1-2H3,(H,26,28)