methyl 4-[2-[5-(4-methoxyphenyl)-1-methyl-imidazol-2-yl]sulfonylethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[5-(4-methoxyphenyl)-1-methyl-imidazol-2-yl]sulfonylethanoylamino]benzoate Openeye Name: methyl 4-[[2-[5-(4-methoxyphenyl)-1-methyl-imidazol-2-yl]sulfonylacetyl]amino]benzoate CAS Name: 4-[[2-[[5-(4-methoxyphenyl)-1-methyl-2-imidazolyl]sulfonyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonylacetyl]amino]benzoate Traditional Name: 4-[[2-[5-(4-methoxyphenyl)-1-methyl-imidazol-2-yl]sulfonylacetyl]amino]benzoic acid methyl ester Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1S(=O)(=O)CC(=O)NC2=CC=C(C=C2)C(=O)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CN1C(=CN=C1S(=O)(=O)CC(=O)NC2=CC=C(C=C2)C(=O)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H21N3O6S/c1-24-18(14-6-10-17(29-2)11-7-14)12-22-21(24)31(27,28)13-19(25)23-16-8-4-15(5-9-16)20(26)30-3/h4-12H,13H2,1-3H3,(H,23,25)