4-[[4-[4-fluoranyl-3-(trifluoromethyl)phenyl]pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[4-[4-fluoranyl-3-(trifluoromethyl)phenyl]pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 4-[[4-[4-fluoro-3-(trifluoromethyl)phenyl]pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 4-[[4-[4-fluoro-3-(trifluoromethyl)phenyl]-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 4-[[4-[4-fluoro-3-(trifluoromethyl)phenyl]pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 4-[[4-[4-fluoro-3-(trifluoromethyl)phenyl]pyrimidin-2-yl]amino]benzenesulfonamide Formula: C17H12F4N4O2S MolecularWeight: 412.361393

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC=CC(=N2)C3=CC(=C(C=C3)F)C(F)(F)F)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1NC2=NC=CC(=N2)C3=CC(=C(C=C3)F)C(F)(F)F)S(=O)(=O)N

InChI

InChI=1S/C17H12F4N4O2S/c18-14-6-1-10(9-13(14)17(19,20)21)15-7-8-23-16(25-15)24-11-2-4-12(5-3-11)28(22,26)27/h1-9H,(H2,22,26,27)(H,23,24,25)