2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-3-methyl-imidazole-4-carboxylate

Systemtic Name: 2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-3-methyl-imidazole-4-carboxylate Openeye Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]-3-methyl-imidazole-4-carboxylate CAS Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]-3-methyl-4-imidazolecarboxylate IUPAC Name: 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-3-methylimidazole-4-carboxylate Traditional Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]-3-methyl-imidazole-4-carboxylate Formula: C11H6ClF3N3O2S- MolecularWeight: 336.69745

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SC2=C(C=C(C=N2)C(F)(F)F)Cl)C(=O)[O-]

Isomeric SMILES

CN1C(=CN=C1SC2=C(C=C(C=N2)C(F)(F)F)Cl)C(=O)[O-]

InChI

InChI=1S/C11H7ClF3N3O2S/c1-18-7(9(19)20)4-17-10(18)21-8-6(12)2-5(3-16-8)11(13,14)15/h2-4H,1H3,(H,19,20)/p-1