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

Systemtic Name: 2-(5-bromanyl-2-pentoxy-phenyl)-4-ethyl-1,3-thiazole-5-carboxylate Openeye Name: 2-(5-bromo-2-pentoxy-phenyl)-4-ethyl-thiazole-5-carboxylate CAS Name: 2-(5-bromo-2-pentoxyphenyl)-4-ethyl-5-thiazolecarboxylate IUPAC Name: 2-(5-bromo-2-pentoxyphenyl)-4-ethyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(2-amoxy-5-bromo-phenyl)-4-ethyl-thiazole-5-carboxylate Formula: C17H19BrNO3S- MolecularWeight: 397.30666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)Br)C2=NC(=C(S2)C(=O)[O-])CC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)Br)C2=NC(=C(S2)C(=O)[O-])CC

InChI

InChI=1S/C17H20BrNO3S/c1-3-5-6-9-22-14-8-7-11(18)10-12(14)16-19-13(4-2)15(23-16)17(20)21/h7-8,10H,3-6,9H2,1-2H3,(H,20,21)/p-1