2-(5-bromanyl-2-ethoxy-3-methoxy-phenyl)-4-ethyl-1,3-thiazole-5-carboxylate

Systemtic Name: 2-(5-bromanyl-2-ethoxy-3-methoxy-phenyl)-4-ethyl-1,3-thiazole-5-carboxylate Openeye Name: 2-(5-bromo-2-ethoxy-3-methoxy-phenyl)-4-ethyl-thiazole-5-carboxylate CAS Name: 2-(5-bromo-2-ethoxy-3-methoxyphenyl)-4-ethyl-5-thiazolecarboxylate IUPAC Name: 2-(5-bromo-2-ethoxy-3-methoxyphenyl)-4-ethyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(5-bromo-2-ethoxy-3-methoxy-phenyl)-4-ethyl-thiazole-5-carboxylate Formula: C15H15BrNO4S- MolecularWeight: 385.2529

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)C2=CC(=CC(=C2OCC)OC)Br)C(=O)[O-]

Isomeric SMILES

CCC1=C(SC(=N1)C2=CC(=CC(=C2OCC)OC)Br)C(=O)[O-]

InChI

InChI=1S/C15H16BrNO4S/c1-4-10-13(15(18)19)22-14(17-10)9-6-8(16)7-11(20-3)12(9)21-5-2/h6-7H,4-5H2,1-3H3,(H,18,19)/p-1