2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-methyl-quinoline-3-carbonitrile

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-methyl-quinoline-3-carbonitrile Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-methyl-quinoline-3-carbonitrile CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-4-methyl-3-quinolinecarbonitrile IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-methylquinoline-3-carbonitrile Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-4-methyl-quinoline-3-carbonitrile Formula: C18H12ClFN2S MolecularWeight: 342.817683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)SCC3=C(C=CC=C3Cl)F)C#N

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)SCC3=C(C=CC=C3Cl)F)C#N

InChI

InChI=1S/C18H12ClFN2S/c1-11-12-5-2-3-8-17(12)22-18(13(11)9-21)23-10-14-15(19)6-4-7-16(14)20/h2-8H,10H2,1H3