4-tert-butyl-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]benzenesulfonamide Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O2S2/c1-15-14-16(2)24-21(23-15)28-19-10-8-18(9-11-19)25-29(26,27)20-12-6-17(7-13-20)22(3,4)5/h6-14,25H,1-5H3