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

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]ethanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[4-(difluoromethylsulfanyl)phenyl]acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-[4-(difluoromethylthio)phenyl]acetamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[4-(difluoromethylsulfanyl)phenyl]acetamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-[4-(difluoromethylthio)phenyl]acetamide Formula: C13H13F2N5OS2 MolecularWeight: 357.402026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CSC2=NC(=CC(=N2)N)N)SC(F)F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CSC2=NC(=CC(=N2)N)N)SC(F)F

InChI

InChI=1S/C13H13F2N5OS2/c14-12(15)23-8-3-1-7(2-4-8)18-11(21)6-22-13-19-9(16)5-10(17)20-13/h1-5,12H,6H2,(H,18,21)(H4,16,17,19,20)