2-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-ethyl-carbamoyl]benzoic acid

Systemtic Name: 2-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-ethyl-carbamoyl]benzoic acid Openeye Name: 2-[[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-ethyl-carbamoyl]benzoic acid CAS Name: 2-[[[4-(2,5-dimethoxyphenyl)-2-thiazolyl]-ethylamino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-ethylcarbamoyl]benzoic acid Traditional Name: 2-[[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-ethyl-carbamoyl]benzoic acid Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC(=CS1)C2=C(C=CC(=C2)OC)OC)C(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CCN(C1=NC(=CS1)C2=C(C=CC(=C2)OC)OC)C(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C21H20N2O5S/c1-4-23(19(24)14-7-5-6-8-15(14)20(25)26)21-22-17(12-29-21)16-11-13(27-2)9-10-18(16)28-3/h5-12H,4H2,1-3H3,(H,25,26)