ethyl 3-[2-[(4-methylphenyl)-pyridin-3-ylsulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-[(4-methylphenyl)-pyridin-3-ylsulfonyl-amino]ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-[4-methyl-N-(3-pyridylsulfonyl)anilino]acetyl]amino]benzoate CAS Name: 3-[[2-[4-methyl-N-(3-pyridinylsulfonyl)anilino]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-methyl-N-pyridin-3-ylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 3-[[2-[4-methyl-N-(3-pyridylsulfonyl)anilino]acetyl]amino]benzoic acid ethyl ester Formula: C23H23N3O5S MolecularWeight: 453.51082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O5S/c1-3-31-23(28)18-6-4-7-19(14-18)25-22(27)16-26(20-11-9-17(2)10-12-20)32(29,30)21-8-5-13-24-15-21/h4-15H,3,16H2,1-2H3,(H,25,27)