N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-2-(6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-2-(6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-2-(6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-[4-(difluoromethylthio)phenyl]-2-[(6-methyl-2-phenyl-4-pyrimidinyl)thio]acetamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-2-(6-methyl-2-phenylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-2-[(6-methyl-2-phenyl-pyrimidin-4-yl)thio]acetamide Formula: C20H17F2N3OS2 MolecularWeight: 417.495286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CC=CC=C2)SCC(=O)NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC=CC=C2)SCC(=O)NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C20H17F2N3OS2/c1-13-11-18(25-19(23-13)14-5-3-2-4-6-14)27-12-17(26)24-15-7-9-16(10-8-15)28-20(21)22/h2-11,20H,12H2,1H3,(H,24,26)