methyl 2-sulfanylidene-3-[1-[4-(trifluoromethyl)phenyl]propyl]-1H-imidazole-4-carboxylate

Systemtic Name: methyl 2-sulfanylidene-3-[1-[4-(trifluoromethyl)phenyl]propyl]-1H-imidazole-4-carboxylate Openeye Name: methyl 2-thioxo-3-[1-[4-(trifluoromethyl)phenyl]propyl]-1H-imidazole-4-carboxylate CAS Name: 2-sulfanylidene-3-[1-[4-(trifluoromethyl)phenyl]propyl]-1H-imidazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-sulfanylidene-3-[1-[4-(trifluoromethyl)phenyl]propyl]-1H-imidazole-4-carboxylate Traditional Name: 2-thioxo-3-[1-[4-(trifluoromethyl)phenyl]propyl]-4-imidazoline-4-carboxylic acid methyl ester Formula: C15H15F3N2O2S MolecularWeight: 344.35201

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C(F)(F)F)N2C(=CNC2=S)C(=O)OC

Isomeric SMILES

CCC(C1=CC=C(C=C1)C(F)(F)F)N2C(=CNC2=S)C(=O)OC

InChI

InChI=1S/C15H15F3N2O2S/c1-3-11(9-4-6-10(7-5-9)15(16,17)18)20-12(13(21)22-2)8-19-14(20)23/h4-8,11H,3H2,1-2H3,(H,19,23)