[cyano(phenyl)methyl] 2-chloranyl-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate

Systemtic Name: [cyano(phenyl)methyl] 2-chloranyl-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate Openeye Name: [cyano(phenyl)methyl] 2-chloro-4-(trifluoromethyl)thiazole-5-carboxylate CAS Name: 2-chloro-4-(trifluoromethyl)-5-thiazolecarboxylic acid [cyano(phenyl)methyl] ester IUPAC Name: [cyano(phenyl)methyl] 2-chloro-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate Traditional Name: 2-chloro-4-(trifluoromethyl)thiazole-5-carboxylic acid [cyano(phenyl)methyl] ester Formula: C13H6ClF3N2O2S MolecularWeight: 346.71215

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)OC(=O)C2=C(N=C(S2)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(C#N)OC(=O)C2=C(N=C(S2)Cl)C(F)(F)F

InChI

InChI=1S/C13H6ClF3N2O2S/c14-12-19-10(13(15,16)17)9(22-12)11(20)21-8(6-18)7-4-2-1-3-5-7/h1-5,8H