2-[4-(4-methylsulfonylphenyl)-2-(trifluoromethyl)-1H-imidazol-5-yl]cyclohexa-2,4-diene-1-thione

Systemtic Name: 2-[4-(4-methylsulfonylphenyl)-2-(trifluoromethyl)-1H-imidazol-5-yl]cyclohexa-2,4-diene-1-thione Openeye Name: 2-[4-(4-methylsulfonylphenyl)-2-(trifluoromethyl)-1H-imidazol-5-yl]cyclohexa-2,4-diene-1-thione CAS Name: 2-[4-(4-methylsulfonylphenyl)-2-(trifluoromethyl)-1H-imidazol-5-yl]-1-cyclohexa-2,4-dienethione IUPAC Name: 2-[4-(4-methylsulfonylphenyl)-2-(trifluoromethyl)-1H-imidazol-5-yl]cyclohexa-2,4-diene-1-thione Traditional Name: 2-[4-(4-mesylphenyl)-2-(trifluoromethyl)-1H-imidazol-5-yl]cyclohexa-2,4-diene-1-thione Formula: C17H13F3N2O2S2 MolecularWeight: 398.42253

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(NC(=N2)C(F)(F)F)C3=CC=CCC3=S

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(NC(=N2)C(F)(F)F)C3=CC=CCC3=S

InChI

InChI=1S/C17H13F3N2O2S2/c1-26(23,24)11-8-6-10(7-9-11)14-15(12-4-2-3-5-13(12)25)22-16(21-14)17(18,19)20/h2-4,6-9H,5H2,1H3,(H,21,22)