ethyl 2-[5-(4-bromophenyl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[5-(4-bromophenyl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[5-(4-bromophenyl)-3-(trifluoromethyl)pyrazol-1-yl]thiazole-4-carboxylate CAS Name: 2-[5-(4-bromophenyl)-3-(trifluoromethyl)-1-pyrazolyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-bromophenyl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[5-(4-bromophenyl)-3-(trifluoromethyl)pyrazol-1-yl]thiazole-4-carboxylic acid ethyl ester Formula: C16H11BrF3N3O2S MolecularWeight: 446.24165

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H11BrF3N3O2S/c1-2-25-14(24)11-8-26-15(21-11)23-12(7-13(22-23)16(18,19)20)9-3-5-10(17)6-4-9/h3-8H,2H2,1H3