3-[2-[bis(fluoranyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]-N-(4-methyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-[2-[bis(fluoranyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]-N-(4-methyl-3-nitro-phenyl)propanamide Openeye Name: 3-[2-(difluoromethylsulfanyl)-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-(4-methyl-3-nitro-phenyl)propanamide CAS Name: 3-[2-(difluoromethylthio)-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-(4-methyl-3-nitrophenyl)propanamide IUPAC Name: 3-[2-(difluoromethylsulfanyl)-6-methyl-4-oxo-1H-pyrimidin-5-yl]-N-(4-methyl-3-nitrophenyl)propanamide Traditional Name: 3-[2-(difluoromethylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]-N-(4-methyl-3-nitro-phenyl)propionamide Formula: C16H16F2N4O4S MolecularWeight: 398.384446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC2=C(NC(=NC2=O)SC(F)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC2=C(NC(=NC2=O)SC(F)F)C)[N+](=O)[O-]

InChI

InChI=1S/C16H16F2N4O4S/c1-8-3-4-10(7-12(8)22(25)26)20-13(23)6-5-11-9(2)19-16(21-14(11)24)27-15(17)18/h3-4,7,15H,5-6H2,1-2H3,(H,20,23)(H,19,21,24)