2-[6-cyano-4-ethyl-4-fluoranyl-3-[3-oxidanylidene-5-(trifluoromethyl)-1H-1,2,4-triazol-2-yl]cyclohexa-1,5-dien-1-yl]ethanesulfonamide

Systemtic Name: 2-[6-cyano-4-ethyl-4-fluoranyl-3-[3-oxidanylidene-5-(trifluoromethyl)-1H-1,2,4-triazol-2-yl]cyclohexa-1,5-dien-1-yl]ethanesulfonamide Openeye Name: 2-[6-cyano-4-ethyl-4-fluoro-3-[3-oxo-5-(trifluoromethyl)-1H-1,2,4-triazol-2-yl]cyclohexa-1,5-dien-1-yl]ethanesulfonamide CAS Name: 2-[6-cyano-4-ethyl-4-fluoro-3-[3-oxo-5-(trifluoromethyl)-1H-1,2,4-triazol-2-yl]-1-cyclohexa-1,5-dienyl]ethanesulfonamide IUPAC Name: 2-[6-cyano-4-ethyl-4-fluoro-3-[3-oxo-5-(trifluoromethyl)-1H-1,2,4-triazol-2-yl]cyclohexa-1,5-dien-1-yl]ethanesulfonamide Traditional Name: 2-[6-cyano-4-ethyl-4-fluoro-3-[3-keto-5-(trifluoromethyl)-1H-1,2,4-triazol-2-yl]cyclohexa-1,5-dien-1-yl]ethanesulfonamide Formula: C14H15F4N5O3S MolecularWeight: 409.359213

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C=C(C(=CC1N2C(=O)N=C(N2)C(F)(F)F)CCS(=O)(=O)N)C#N)F

Isomeric SMILES

CCC1(C=C(C(=CC1N2C(=O)N=C(N2)C(F)(F)F)CCS(=O)(=O)N)C#N)F

InChI

InChI=1S/C14H15F4N5O3S/c1-2-13(15)6-9(7-19)8(3-4-27(20,25)26)5-10(13)23-12(24)21-11(22-23)14(16,17)18/h5-6,10H,2-4H2,1H3,(H2,20,25,26)(H,21,22,24)