2-(3-bromanyl-5-chloranyl-2-propoxy-phenyl)-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-(3-bromanyl-5-chloranyl-2-propoxy-phenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(3-bromo-5-chloro-2-propoxy-phenyl)-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-(3-bromo-5-chloro-2-propoxyphenyl)-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-(3-bromo-5-chloro-2-propoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(3-bromo-5-chloro-2-propoxy-phenyl)-4-methyl-thiazole-5-carboxylic acid Formula: C14H13BrClNO3S MolecularWeight: 390.67992

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1C2=NC(=C(S2)C(=O)O)C)Cl)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1C2=NC(=C(S2)C(=O)O)C)Cl)Br

InChI

InChI=1S/C14H13BrClNO3S/c1-3-4-20-11-9(5-8(16)6-10(11)15)13-17-7(2)12(21-13)14(18)19/h5-6H,3-4H2,1-2H3,(H,18,19)