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

Systemtic Name: 3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-N-[[2-(trifluoromethyloxy)phenyl]methyl]propanamide Openeye Name: 3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-N-[[2-(trifluoromethoxy)phenyl]methyl]propanamide CAS Name: 3-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]-N-[[2-(trifluoromethoxy)phenyl]methyl]propanamide IUPAC Name: 3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-N-[[2-(trifluoromethoxy)phenyl]methyl]propanamide Traditional Name: 3-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]-N-[2-(trifluoromethoxy)benzyl]propionamide Formula: C17H18F3N3O3S MolecularWeight: 401.40333

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NCC2=CC=CC=C2OC(F)(F)F

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NCC2=CC=CC=C2OC(F)(F)F

InChI

InChI=1S/C17H18F3N3O3S/c1-10-12(15(25)23-16(22-10)27-2)7-8-14(24)21-9-11-5-3-4-6-13(11)26-17(18,19)20/h3-6H,7-9H2,1-2H3,(H,21,24)(H,22,23,25)