methyl 3-methyl-2-[2-oxidanylidene-2-[3-(trifluoromethyl)phenyl]ethyl]sulfanyl-imidazole-4-carboxylate

Systemtic Name: methyl 3-methyl-2-[2-oxidanylidene-2-[3-(trifluoromethyl)phenyl]ethyl]sulfanyl-imidazole-4-carboxylate Openeye Name: methyl 3-methyl-2-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]sulfanyl-imidazole-4-carboxylate CAS Name: 3-methyl-2-[[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]thio]-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-2-[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]sulfanylimidazole-4-carboxylate Traditional Name: 2-[[2-keto-2-[3-(trifluoromethyl)phenyl]ethyl]thio]-3-methyl-imidazole-4-carboxylic acid methyl ester Formula: C15H13F3N2O3S MolecularWeight: 358.33553

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC(=O)C2=CC(=CC=C2)C(F)(F)F)C(=O)OC

Isomeric SMILES

CN1C(=CN=C1SCC(=O)C2=CC(=CC=C2)C(F)(F)F)C(=O)OC

InChI

InChI=1S/C15H13F3N2O3S/c1-20-11(13(22)23-2)7-19-14(20)24-8-12(21)9-4-3-5-10(6-9)15(16,17)18/h3-7H,8H2,1-2H3