5-[(2-bromanylphenoxy)methyl]-2-phenethyl-1,3-thiazole-4-carboxylic acid

Systemtic Name: 5-[(2-bromanylphenoxy)methyl]-2-phenethyl-1,3-thiazole-4-carboxylic acid Openeye Name: 5-[(2-bromophenoxy)methyl]-2-phenethyl-thiazole-4-carboxylic acid CAS Name: 5-[(2-bromophenoxy)methyl]-2-phenethyl-4-thiazolecarboxylic acid IUPAC Name: 5-[(2-bromophenoxy)methyl]-2-phenethyl-1,3-thiazole-4-carboxylic acid Traditional Name: 5-[(2-bromophenoxy)methyl]-2-phenethyl-thiazole-4-carboxylic acid Formula: C19H16BrNO3S MolecularWeight: 418.30424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NC(=C(S2)COC3=CC=CC=C3Br)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NC(=C(S2)COC3=CC=CC=C3Br)C(=O)O

InChI

InChI=1S/C19H16BrNO3S/c20-14-8-4-5-9-15(14)24-12-16-18(19(22)23)21-17(25-16)11-10-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,22,23)