ethyl 3-methyl-2-[3,4,4-tris(fluoranyl)but-3-enylsulfanyl]imidazole-4-carboxylate

Systemtic Name: ethyl 3-methyl-2-[3,4,4-tris(fluoranyl)but-3-enylsulfanyl]imidazole-4-carboxylate Openeye Name: ethyl 3-methyl-2-(3,4,4-trifluorobut-3-enylsulfanyl)imidazole-4-carboxylate CAS Name: 3-methyl-2-(3,4,4-trifluorobut-3-enylthio)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-2-(3,4,4-trifluorobut-3-enylsulfanyl)imidazole-4-carboxylate Traditional Name: 3-methyl-2-(3,4,4-trifluorobut-3-enylthio)imidazole-4-carboxylic acid ethyl ester Formula: C11H13F3N2O2S MolecularWeight: 294.29333

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N1C)SCCC(=C(F)F)F

Isomeric SMILES

CCOC(=O)C1=CN=C(N1C)SCCC(=C(F)F)F

InChI

InChI=1S/C11H13F3N2O2S/c1-3-18-10(17)8-6-15-11(16(8)2)19-5-4-7(12)9(13)14/h6H,3-5H2,1-2H3