2-[2,4-bis[bis(fluoranyl)methylsulfonyl]phenyl]sulfanyl-4,6-dimethyl-pyrimidine

Systemtic Name: 2-[2,4-bis[bis(fluoranyl)methylsulfonyl]phenyl]sulfanyl-4,6-dimethyl-pyrimidine Openeye Name: 2-[2,4-bis(difluoromethylsulfonyl)phenyl]sulfanyl-4,6-dimethyl-pyrimidine CAS Name: 2-[[2,4-bis(difluoromethylsulfonyl)phenyl]thio]-4,6-dimethylpyrimidine IUPAC Name: 2-[2,4-bis(difluoromethylsulfonyl)phenyl]sulfanyl-4,6-dimethylpyrimidine Traditional Name: 2-[[2,4-bis(difluoromethylsulfonyl)phenyl]thio]-4,6-dimethyl-pyrimidine Formula: C14H12F4N2O4S3 MolecularWeight: 444.444693

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12F4N2O4S3/c1-7-5-8(2)20-14(19-7)25-10-4-3-9(26(21,22)12(15)16)6-11(10)27(23,24)13(17)18/h3-6,12-13H,1-2H3