N-(4,6-dimethylpyrimidin-2-yl)-4-[3-(4-methoxyoxan-4-yl)phenyl]sulfanyl-benzenesulfonamide

Systemtic Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[3-(4-methoxyoxan-4-yl)phenyl]sulfanyl-benzenesulfonamide Openeye Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[3-(4-methoxytetrahydropyran-4-yl)phenyl]sulfanyl-benzenesulfonamide CAS Name: N-(4,6-dimethyl-2-pyrimidinyl)-4-[[3-(4-methoxy-4-oxanyl)phenyl]thio]benzenesulfonamide IUPAC Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[3-(4-methoxyoxan-4-yl)phenyl]sulfanylbenzenesulfonamide Traditional Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[[3-(4-methoxytetrahydropyran-4-yl)phenyl]thio]benzenesulfonamide Formula: C24H27N3O4S2 MolecularWeight: 485.61888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)SC3=CC=CC(=C3)C4(CCOCC4)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)SC3=CC=CC(=C3)C4(CCOCC4)OC)C

InChI

InChI=1S/C24H27N3O4S2/c1-17-15-18(2)26-23(25-17)27-33(28,29)22-9-7-20(8-10-22)32-21-6-4-5-19(16-21)24(30-3)11-13-31-14-12-24/h4-10,15-16H,11-14H2,1-3H3,(H,25,26,27)