1-(3,5-dimethylphenyl)-3-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrazin-2-one

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrazin-2-one Openeye Name: 1-(3,5-dimethylphenyl)-3-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrazin-2-one CAS Name: 1-(3,5-dimethylphenyl)-3-[[3-(trifluoromethyl)phenyl]methylthio]-2-pyrazinone IUPAC Name: 1-(3,5-dimethylphenyl)-3-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrazin-2-one Traditional Name: 1-(3,5-dimethylphenyl)-3-[[3-(trifluoromethyl)benzyl]thio]pyrazin-2-one Formula: C20H17F3N2OS MolecularWeight: 390.42199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C(C2=O)SCC3=CC(=CC=C3)C(F)(F)F)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C(C2=O)SCC3=CC(=CC=C3)C(F)(F)F)C

InChI

InChI=1S/C20H17F3N2OS/c1-13-8-14(2)10-17(9-13)25-7-6-24-18(19(25)26)27-12-15-4-3-5-16(11-15)20(21,22)23/h3-11H,12H2,1-2H3