4-fluoranyl-N'-(4-methylphenyl)sulfonyl-N-[4-(trifluoromethyloxy)phenyl]benzenecarboximidamide

Systemtic Name: 4-fluoranyl-N'-(4-methylphenyl)sulfonyl-N-[4-(trifluoromethyloxy)phenyl]benzenecarboximidamide Openeye Name: 4-fluoro-N'-(p-tolylsulfonyl)-N-[4-(trifluoromethoxy)phenyl]benzamidine CAS Name: 4-fluoro-N'-(4-methylphenyl)sulfonyl-N-[4-(trifluoromethoxy)phenyl]benzenecarboximidamide IUPAC Name: 4-fluoro-N'-(4-methylphenyl)sulfonyl-N-[4-(trifluoromethoxy)phenyl]benzenecarboximidamide Traditional Name: 4-fluoro-N'-tosyl-N-[4-(trifluoromethoxy)phenyl]benzamidine Formula: C21H16F4N2O3S MolecularWeight: 452.421953

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(C2=CC=C(C=C2)F)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/N=C(\C2=CC=C(C=C2)F)/NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H16F4N2O3S/c1-14-2-12-19(13-3-14)31(28,29)27-20(15-4-6-16(22)7-5-15)26-17-8-10-18(11-9-17)30-21(23,24)25/h2-13H,1H3,(H,26,27)