4-tert-butyl-N-[6-(2-chloranyl-5-methoxy-phenyl)sulfanyl-2-methyl-pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[6-(2-chloranyl-5-methoxy-phenyl)sulfanyl-2-methyl-pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[6-(2-chloro-5-methoxy-phenyl)sulfanyl-2-methyl-pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[6-[(2-chloro-5-methoxyphenyl)thio]-2-methyl-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[6-(2-chloro-5-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[6-[(2-chloro-5-methoxy-phenyl)thio]-2-methyl-pyrimidin-4-yl]benzenesulfonamide Formula: C22H24ClN3O3S2 MolecularWeight: 478.02726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)SC2=C(C=CC(=C2)OC)Cl)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=NC(=CC(=N1)SC2=C(C=CC(=C2)OC)Cl)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

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