2-(phenylmethylsulfanyl)-3-prop-2-enyl-6-(trifluoromethyl)pyrimidin-4-one

Systemtic Name: 2-(phenylmethylsulfanyl)-3-prop-2-enyl-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 3-allyl-2-benzylsulfanyl-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 2-(phenylmethylthio)-3-prop-2-enyl-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 2-benzylsulfanyl-3-prop-2-enyl-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 3-allyl-2-(benzylthio)-6-(trifluoromethyl)pyrimidin-4-one Formula: C15H13F3N2OS MolecularWeight: 326.33673

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C=C(N=C1SCC2=CC=CC=C2)C(F)(F)F

Isomeric SMILES

C=CCN1C(=O)C=C(N=C1SCC2=CC=CC=C2)C(F)(F)F

InChI

InChI=1S/C15H13F3N2OS/c1-2-8-20-13(21)9-12(15(16,17)18)19-14(20)22-10-11-6-4-3-5-7-11/h2-7,9H,1,8,10H2