2-[4-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1H-pyrimidin-6-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[4-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1H-pyrimidin-6-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-oxo-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1H-pyrimidin-6-yl]acetamide CAS Name: 2-[4-oxo-2-[[3-(trifluoromethyl)phenyl]methylthio]-1H-pyrimidin-6-yl]-N-prop-2-enylacetamide IUPAC Name: 2-[4-oxo-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1H-pyrimidin-6-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[4-keto-2-[[3-(trifluoromethyl)benzyl]thio]-1H-pyrimidin-6-yl]acetamide Formula: C17H16F3N3O2S MolecularWeight: 383.38805

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16F3N3O2S/c1-2-6-21-14(24)8-13-9-15(25)23-16(22-13)26-10-11-4-3-5-12(7-11)17(18,19)20/h2-5,7,9H,1,6,8,10H2,(H,21,24)(H,22,23,25)