2-[2-[2-(2-tert-butyl-4-methoxy-phenoxy)ethylamino]-2-oxidanylidene-ethyl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[2-[2-(2-tert-butyl-4-methoxy-phenoxy)ethylamino]-2-oxidanylidene-ethyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[2-[2-(2-tert-butyl-4-methoxy-phenoxy)ethylamino]-2-oxo-ethyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[2-[2-(2-tert-butyl-4-methoxyphenoxy)ethylamino]-2-oxoethyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[2-[2-(2-tert-butyl-4-methoxyphenoxy)ethylamino]-2-oxoethyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[2-[2-(2-tert-butyl-4-methoxy-phenoxy)ethylamino]-2-keto-ethyl]-4-methyl-thiazole-5-carboxylic acid Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC(=O)NCCOC2=C(C=C(C=C2)OC)C(C)(C)C)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)CC(=O)NCCOC2=C(C=C(C=C2)OC)C(C)(C)C)C(=O)O

InChI

InChI=1S/C20H26N2O5S/c1-12-18(19(24)25)28-17(22-12)11-16(23)21-8-9-27-15-7-6-13(26-5)10-14(15)20(2,3)4/h6-7,10H,8-9,11H2,1-5H3,(H,21,23)(H,24,25)