6-methyl-2-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile

Systemtic Name: 6-methyl-2-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Openeye Name: 6-methyl-2-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile CAS Name: 6-methyl-2-[[2-(trifluoromethyl)phenyl]methylthio]-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile IUPAC Name: 6-methyl-2-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Traditional Name: 6-methyl-2-[[2-(trifluoromethyl)benzyl]thio]-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Formula: C18H16F3N3S MolecularWeight: 363.39995

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)C=C(C(=N2)SCC3=CC=CC=C3C(F)(F)F)C#N

Isomeric SMILES

CN1CCC2=C(C1)C=C(C(=N2)SCC3=CC=CC=C3C(F)(F)F)C#N

InChI

InChI=1S/C18H16F3N3S/c1-24-7-6-16-14(10-24)8-13(9-22)17(23-16)25-11-12-4-2-3-5-15(12)18(19,20)21/h2-5,8H,6-7,10-11H2,1H3