4-tert-butyl-N-[6-chloranyl-5-(2-fluoranyl-6-methoxy-phenoxy)pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[6-chloranyl-5-(2-fluoranyl-6-methoxy-phenoxy)pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[6-chloro-5-(2-fluoro-6-methoxy-phenoxy)pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[6-chloro-5-(2-fluoro-6-methoxyphenoxy)-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[6-chloro-5-(2-fluoro-6-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[6-chloro-5-(2-fluoro-6-methoxy-phenoxy)pyrimidin-4-yl]benzenesulfonamide Formula: C21H21ClFN3O4S MolecularWeight: 465.925543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)Cl)OC3=C(C=CC=C3F)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)Cl)OC3=C(C=CC=C3F)OC

InChI

InChI=1S/C21H21ClFN3O4S/c1-21(2,3)13-8-10-14(11-9-13)31(27,28)26-20-18(19(22)24-12-25-20)30-17-15(23)6-5-7-16(17)29-4/h5-12H,1-4H3,(H,24,25,26)