2-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethylamino]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethylamino]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[2-(4-bromo-2,6-dimethyl-phenoxy)ethylamino]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[2-(4-bromo-2,6-dimethylphenoxy)ethylamino]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[2-(4-bromo-2,6-dimethylphenoxy)ethylamino]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[2-(4-bromo-2,6-dimethyl-phenoxy)ethylamino]-4-methyl-thiazole-5-carboxylic acid Formula: C15H17BrN2O3S MolecularWeight: 385.27608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCNC2=NC(=C(S2)C(=O)O)C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCCNC2=NC(=C(S2)C(=O)O)C)C)Br

InChI

InChI=1S/C15H17BrN2O3S/c1-8-6-11(16)7-9(2)12(8)21-5-4-17-15-18-10(3)13(22-15)14(19)20/h6-7H,4-5H2,1-3H3,(H,17,18)(H,19,20)