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

Systemtic Name: 2-(3-bromanyl-4-propoxy-phenyl)-4-ethyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(3-bromo-4-propoxy-phenyl)-4-ethyl-thiazole-5-carboxylic acid CAS Name: 2-(3-bromo-4-propoxyphenyl)-4-ethyl-5-thiazolecarboxylic acid IUPAC Name: 2-(3-bromo-4-propoxyphenyl)-4-ethyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(3-bromo-4-propoxy-phenyl)-4-ethyl-thiazole-5-carboxylic acid Formula: C15H16BrNO3S MolecularWeight: 370.26144

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2=NC(=C(S2)C(=O)O)CC)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2=NC(=C(S2)C(=O)O)CC)Br

InChI

InChI=1S/C15H16BrNO3S/c1-3-7-20-12-6-5-9(8-10(12)16)14-17-11(4-2)13(21-14)15(18)19/h5-6,8H,3-4,7H2,1-2H3,(H,18,19)