2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-5,8-dimethyl-quinoline-3-carbonitrile

Systemtic Name: 2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-5,8-dimethyl-quinoline-3-carbonitrile Openeye Name: 2-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-5,8-dimethyl-quinoline-3-carbonitrile CAS Name: 2-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-5,8-dimethyl-3-quinolinecarbonitrile IUPAC Name: 2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-5,8-dimethylquinoline-3-carbonitrile Traditional Name: 2-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]-5,8-dimethyl-quinoline-3-carbonitrile Formula: C20H15FN2OS MolecularWeight: 350.409303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)C3=CC=C(C=C3)F)C#N

Isomeric SMILES

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)C3=CC=C(C=C3)F)C#N

InChI

InChI=1S/C20H15FN2OS/c1-12-3-4-13(2)19-17(12)9-15(10-22)20(23-19)25-11-18(24)14-5-7-16(21)8-6-14/h3-9H,11H2,1-2H3