3-[6-[[4-(trifluoromethyloxy)phenyl]amino]pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 3-[6-[[4-(trifluoromethyloxy)phenyl]amino]pyrimidin-4-yl]benzenesulfonamide Openeye Name: 3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzenesulfonamide CAS Name: 3-[6-[4-(trifluoromethoxy)anilino]-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzenesulfonamide Traditional Name: 3-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzenesulfonamide Formula: C17H13F3N4O3S MolecularWeight: 410.37033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)N)C2=CC(=NC=N2)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)N)C2=CC(=NC=N2)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C17H13F3N4O3S/c18-17(19,20)27-13-6-4-12(5-7-13)24-16-9-15(22-10-23-16)11-2-1-3-14(8-11)28(21,25)26/h1-10H,(H2,21,25,26)(H,22,23,24)