ethyl 3-[2-[2-(4-chlorophenyl)-5-methyl-1,3-thiazol-4-yl]ethanoyl-methylsulfonyl-amino]benzoate

Systemtic Name: ethyl 3-[2-[2-(4-chlorophenyl)-5-methyl-1,3-thiazol-4-yl]ethanoyl-methylsulfonyl-amino]benzoate Openeye Name: ethyl 3-[[2-[2-(4-chlorophenyl)-5-methyl-thiazol-4-yl]acetyl]-methylsulfonyl-amino]benzoate CAS Name: 3-[[2-[2-(4-chlorophenyl)-5-methyl-4-thiazolyl]-1-oxoethyl]-methylsulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[2-(4-chlorophenyl)-5-methyl-1,3-thiazol-4-yl]acetyl]-methylsulfonylamino]benzoate Traditional Name: 3-[[2-[2-(4-chlorophenyl)-5-methyl-thiazol-4-yl]acetyl]-mesyl-amino]benzoic acid ethyl ester Formula: C22H21ClN2O5S2 MolecularWeight: 492.99554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)N(C(=O)CC2=C(SC(=N2)C3=CC=C(C=C3)Cl)C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)N(C(=O)CC2=C(SC(=N2)C3=CC=C(C=C3)Cl)C)S(=O)(=O)C

InChI

InChI=1S/C22H21ClN2O5S2/c1-4-30-22(27)16-6-5-7-18(12-16)25(32(3,28)29)20(26)13-19-14(2)31-21(24-19)15-8-10-17(23)11-9-15/h5-12H,4,13H2,1-3H3