4-tert-butyl-2-chloranyl-6-methyl-3-(2-methylsulfanylphenoxy)-N-pyrimidin-4-yl-benzenesulfonamide

Systemtic Name: 4-tert-butyl-2-chloranyl-6-methyl-3-(2-methylsulfanylphenoxy)-N-pyrimidin-4-yl-benzenesulfonamide Openeye Name: 4-tert-butyl-2-chloro-6-methyl-3-(2-methylsulfanylphenoxy)-N-pyrimidin-4-yl-benzenesulfonamide CAS Name: 4-tert-butyl-2-chloro-6-methyl-3-[2-(methylthio)phenoxy]-N-(4-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-tert-butyl-2-chloro-6-methyl-3-(2-methylsulfanylphenoxy)-N-pyrimidin-4-ylbenzenesulfonamide Traditional Name: 4-tert-butyl-2-chloro-6-methyl-3-[2-(methylthio)phenoxy]-N-(4-pyrimidyl)benzenesulfonamide Formula: C22H24ClN3O3S2 MolecularWeight: 478.02726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C(C)(C)C)OC2=CC=CC=C2SC)Cl)S(=O)(=O)NC3=NC=NC=C3

Isomeric SMILES

CC1=C(C(=C(C(=C1)C(C)(C)C)OC2=CC=CC=C2SC)Cl)S(=O)(=O)NC3=NC=NC=C3

InChI

InChI=1S/C22H24ClN3O3S2/c1-14-12-15(22(2,3)4)20(29-16-8-6-7-9-17(16)30-5)19(23)21(14)31(27,28)26-18-10-11-24-13-25-18/h6-13H,1-5H3,(H,24,25,26)