N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3,4-bis(fluoranyl)benzenesulfonamide

Systemtic Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3,4-bis(fluoranyl)benzenesulfonamide Openeye Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3,4-difluoro-benzenesulfonamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-3,4-difluorobenzenesulfonamide IUPAC Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-3,4-difluorobenzenesulfonamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-3,4-difluoro-benzenesulfonamide Formula: C18H15F2N3O2S2 MolecularWeight: 407.457406

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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)F)F)C

Isomeric SMILES

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

InChI

InChI=1S/C18H15F2N3O2S2/c1-11-9-12(2)22-18(21-11)26-14-5-3-13(4-6-14)23-27(24,25)15-7-8-16(19)17(20)10-15/h3-10,23H,1-2H3