2-methylsulfanyl-4-oxidanylidene-1-[3-(trifluoromethyl)phenyl]quinoline-3-carbonitrile

Systemtic Name: 2-methylsulfanyl-4-oxidanylidene-1-[3-(trifluoromethyl)phenyl]quinoline-3-carbonitrile Openeye Name: 2-methylsulfanyl-4-oxo-1-[3-(trifluoromethyl)phenyl]quinoline-3-carbonitrile CAS Name: 2-(methylthio)-4-oxo-1-[3-(trifluoromethyl)phenyl]-3-quinolinecarbonitrile IUPAC Name: 2-methylsulfanyl-4-oxo-1-[3-(trifluoromethyl)phenyl]quinoline-3-carbonitrile Traditional Name: 4-keto-2-(methylthio)-1-[3-(trifluoromethyl)phenyl]quinoline-3-carbonitrile Formula: C18H11F3N2OS MolecularWeight: 360.35295

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)C2=CC=CC=C2N1C3=CC=CC(=C3)C(F)(F)F)C#N

Isomeric SMILES

CSC1=C(C(=O)C2=CC=CC=C2N1C3=CC=CC(=C3)C(F)(F)F)C#N

InChI

InChI=1S/C18H11F3N2OS/c1-25-17-14(10-22)16(24)13-7-2-3-8-15(13)23(17)12-6-4-5-11(9-12)18(19,20)21/h2-9H,1H3