ethyl 5-[2-(4-bromanyl-2-chloranyl-phenoxy)propanoylamino]-3-methyl-1,2-thiazole-4-carboxylate

Systemtic Name: ethyl 5-[2-(4-bromanyl-2-chloranyl-phenoxy)propanoylamino]-3-methyl-1,2-thiazole-4-carboxylate Openeye Name: ethyl 5-[2-(4-bromo-2-chloro-phenoxy)propanoylamino]-3-methyl-isothiazole-4-carboxylate CAS Name: 5-[[2-(4-bromo-2-chlorophenoxy)-1-oxopropyl]amino]-3-methyl-4-isothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(4-bromo-2-chlorophenoxy)propanoylamino]-3-methyl-1,2-thiazole-4-carboxylate Traditional Name: 5-[2-(4-bromo-2-chloro-phenoxy)propanoylamino]-3-methyl-isothiazole-4-carboxylic acid ethyl ester Formula: C16H16BrClN2O4S MolecularWeight: 447.73124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SN=C1C)NC(=O)C(C)OC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CCOC(=O)C1=C(SN=C1C)NC(=O)C(C)OC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C16H16BrClN2O4S/c1-4-23-16(22)13-8(2)20-25-15(13)19-14(21)9(3)24-12-6-5-10(17)7-11(12)18/h5-7,9H,4H2,1-3H3,(H,19,21)