6-methoxy-2-(phenylmethylsulfanyl)quinoline-3-carbonitrile

Systemtic Name: 6-methoxy-2-(phenylmethylsulfanyl)quinoline-3-carbonitrile Openeye Name: 2-benzylsulfanyl-6-methoxy-quinoline-3-carbonitrile CAS Name: 6-methoxy-2-(phenylmethylthio)-3-quinolinecarbonitrile IUPAC Name: 2-benzylsulfanyl-6-methoxyquinoline-3-carbonitrile Traditional Name: 2-(benzylthio)-6-methoxy-quinoline-3-carbonitrile Formula: C18H14N2OS MolecularWeight: 306.38156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC3=CC=CC=C3

InChI

InChI=1S/C18H14N2OS/c1-21-16-7-8-17-14(10-16)9-15(11-19)18(20-17)22-12-13-5-3-2-4-6-13/h2-10H,12H2,1H3