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

Systemtic Name: 3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)-N-[[2-(trifluoromethyloxy)phenyl]methyl]propanamide Openeye Name: 3-(6-methyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)-N-[[2-(trifluoromethoxy)phenyl]methyl]propanamide CAS Name: 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-N-[[2-(trifluoromethoxy)phenyl]methyl]propanamide IUPAC Name: 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-N-[[2-(trifluoromethoxy)phenyl]methyl]propanamide Traditional Name: 3-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)-N-[2-(trifluoromethoxy)benzyl]propionamide Formula: C16H16F3N3O3S MolecularWeight: 387.37675

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=S)N1)CCC(=O)NCC2=CC=CC=C2OC(F)(F)F

Isomeric SMILES

CC1=C(C(=O)NC(=S)N1)CCC(=O)NCC2=CC=CC=C2OC(F)(F)F

InChI

InChI=1S/C16H16F3N3O3S/c1-9-11(14(24)22-15(26)21-9)6-7-13(23)20-8-10-4-2-3-5-12(10)25-16(17,18)19/h2-5H,6-8H2,1H3,(H,20,23)(H2,21,22,24,26)