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

Systemtic Name: 6-methyl-2-(3-methylbutylsulfanyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-isopentylsulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 6-methyl-2-(3-methylbutylthio)-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 6-methyl-2-(3-methylbutylsulfanyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-(isoamylthio)-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C16H22N2S MolecularWeight: 274.42428

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(C(=N2)SCCC(C)C)C#N

Isomeric SMILES

CC1CCC2=C(C1)C=C(C(=N2)SCCC(C)C)C#N

InChI

InChI=1S/C16H22N2S/c1-11(2)6-7-19-16-14(10-17)9-13-8-12(3)4-5-15(13)18-16/h9,11-12H,4-8H2,1-3H3