4-[(3E)-3-(3-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide

Systemtic Name: 4-[(3E)-3-(3-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide Openeye Name: 4-[(3E)-3-(3-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide CAS Name: 4-[(3E)-3-(3-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide IUPAC Name: 4-[(3E)-3-(3-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide Traditional Name: 4-[(5E)-5-(4-keto-3-methyl-cyclohexa-2,5-dien-1-ylidene)-3-(trifluoromethyl)-3-pyrazolin-1-yl]benzenesulfonamide Formula: C17H14F3N3O3S MolecularWeight: 397.37157

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)C=CC1=O

Isomeric SMILES

CC1=C/C(=C/2\C=C(NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)/C=CC1=O

InChI

InChI=1S/C17H14F3N3O3S/c1-10-8-11(2-7-15(10)24)14-9-16(17(18,19)20)22-23(14)12-3-5-13(6-4-12)27(21,25)26/h2-9,22H,1H3,(H2,21,25,26)/b14-11+