2-(octylsulfanylmethylsulfanyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-(octylsulfanylmethylsulfanyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-(octylsulfanylmethylsulfanyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[(octylthio)methylthio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-(octylsulfanylmethylsulfanyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[(octylthio)methylthio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C19H28N2S2 MolecularWeight: 348.56902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSCSC1=NC2=C(CCCC2)C=C1C#N

Isomeric SMILES

CCCCCCCCSCSC1=NC2=C(CCCC2)C=C1C#N

InChI

InChI=1S/C19H28N2S2/c1-2-3-4-5-6-9-12-22-15-23-19-17(14-20)13-16-10-7-8-11-18(16)21-19/h13H,2-12,15H2,1H3