4-[[7-methoxy-4-(trifluoromethyl)quinolin-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[7-methoxy-4-(trifluoromethyl)quinolin-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[7-methoxy-4-(trifluoromethyl)-2-quinolyl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[7-methoxy-4-(trifluoromethyl)-2-quinolinyl]thio]methyl]benzonitrile IUPAC Name: 4-[[7-methoxy-4-(trifluoromethyl)quinolin-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[7-methoxy-4-(trifluoromethyl)-2-quinolyl]thio]methyl]benzonitrile Formula: C19H13F3N2OS MolecularWeight: 374.37953

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=N2)SCC3=CC=C(C=C3)C#N)C(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=N2)SCC3=CC=C(C=C3)C#N)C(F)(F)F

InChI

InChI=1S/C19H13F3N2OS/c1-25-14-6-7-15-16(19(20,21)22)9-18(24-17(15)8-14)26-11-13-4-2-12(10-23)3-5-13/h2-9H,11H2,1H3