2-[4-methyl-6-oxidanylidene-2-(phenylmethylsulfanyl)pyrimidin-1-yl]-N-[2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[4-methyl-6-oxidanylidene-2-(phenylmethylsulfanyl)pyrimidin-1-yl]-N-[2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(2-benzylsulfanyl-4-methyl-6-oxo-pyrimidin-1-yl)-N-[2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[4-methyl-6-oxo-2-(phenylmethylthio)-1-pyrimidinyl]-N-[2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(2-benzylsulfanyl-4-methyl-6-oxopyrimidin-1-yl)-N-[2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[2-(benzylthio)-6-keto-4-methyl-pyrimidin-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide Formula: C21H18F3N3O2S MolecularWeight: 433.44673

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC2=CC=CC=C2)CC(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC2=CC=CC=C2)CC(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H18F3N3O2S/c1-14-11-19(29)27(20(25-14)30-13-15-7-3-2-4-8-15)12-18(28)26-17-10-6-5-9-16(17)21(22,23)24/h2-11H,12-13H2,1H3,(H,26,28)