N-[3,4-bis(fluoranyl)phenyl]-2-[(6-methyl-2-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]ethanamide

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-2-[(6-methyl-2-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]ethanamide Openeye Name: N-(3,4-difluorophenyl)-2-[(6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]acetamide CAS Name: N-(3,4-difluorophenyl)-2-[(6-methyl-2-oxo-1H-pyrimidin-4-yl)thio]acetamide IUPAC Name: N-(3,4-difluorophenyl)-2-[(6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]acetamide Traditional Name: N-(3,4-difluorophenyl)-2-[(2-keto-6-methyl-1H-pyrimidin-4-yl)thio]acetamide Formula: C13H11F2N3O2S MolecularWeight: 311.307146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=O)N1)SCC(=O)NC2=CC(=C(C=C2)F)F

Isomeric SMILES

CC1=CC(=NC(=O)N1)SCC(=O)NC2=CC(=C(C=C2)F)F

InChI

InChI=1S/C13H11F2N3O2S/c1-7-4-12(18-13(20)16-7)21-6-11(19)17-8-2-3-9(14)10(15)5-8/h2-5H,6H2,1H3,(H,17,19)(H,16,18,20)