7,8-dimethyl-2-phenacylsulfanyl-quinoline-3-carbonitrile

Systemtic Name: 7,8-dimethyl-2-phenacylsulfanyl-quinoline-3-carbonitrile Openeye Name: 7,8-dimethyl-2-phenacylsulfanyl-quinoline-3-carbonitrile CAS Name: 7,8-dimethyl-2-(phenacylthio)-3-quinolinecarbonitrile IUPAC Name: 7,8-dimethyl-2-phenacylsulfanylquinoline-3-carbonitrile Traditional Name: 7,8-dimethyl-2-(phenacylthio)quinoline-3-carbonitrile Formula: C20H16N2OS MolecularWeight: 332.41884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=N2)SCC(=O)C3=CC=CC=C3)C#N)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=N2)SCC(=O)C3=CC=CC=C3)C#N)C

InChI

InChI=1S/C20H16N2OS/c1-13-8-9-16-10-17(11-21)20(22-19(16)14(13)2)24-12-18(23)15-6-4-3-5-7-15/h3-10H,12H2,1-2H3