4-[3-[2-[bis(fluoranyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanoylamino]benzamide

Systemtic Name: 4-[3-[2-[bis(fluoranyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanoylamino]benzamide Openeye Name: 4-[3-[2-(difluoromethylsulfanyl)-6-methyl-4-oxo-1H-pyrimidin-5-yl]propanoylamino]benzamide CAS Name: 4-[[3-[2-(difluoromethylthio)-6-methyl-4-oxo-1H-pyrimidin-5-yl]-1-oxopropyl]amino]benzamide IUPAC Name: 4-[3-[2-(difluoromethylsulfanyl)-6-methyl-4-oxo-1H-pyrimidin-5-yl]propanoylamino]benzamide Traditional Name: 4-[3-[2-(difluoromethylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]propanoylamino]benzamide Formula: C16H16F2N4O3S MolecularWeight: 382.385046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC(F)F)CCC(=O)NC2=CC=C(C=C2)C(=O)N

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC(F)F)CCC(=O)NC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C16H16F2N4O3S/c1-8-11(14(25)22-16(20-8)26-15(17)18)6-7-12(23)21-10-4-2-9(3-5-10)13(19)24/h2-5,15H,6-7H2,1H3,(H2,19,24)(H,21,23)(H,20,22,25)