6,6-dimethyl-2-(phenylmethylsulfanyl)-7,8-dihydro-5H-quinoline-3-carbonitrile

Systemtic Name: 6,6-dimethyl-2-(phenylmethylsulfanyl)-7,8-dihydro-5H-quinoline-3-carbonitrile Openeye Name: 2-benzylsulfanyl-6,6-dimethyl-7,8-dihydro-5H-quinoline-3-carbonitrile CAS Name: 6,6-dimethyl-2-(phenylmethylthio)-7,8-dihydro-5H-quinoline-3-carbonitrile IUPAC Name: 2-benzylsulfanyl-6,6-dimethyl-7,8-dihydro-5H-quinoline-3-carbonitrile Traditional Name: 2-(benzylthio)-6,6-dimethyl-7,8-dihydro-5H-quinoline-3-carbonitrile Formula: C19H20N2S MolecularWeight: 308.4405

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(C1)C=C(C(=N2)SCC3=CC=CC=C3)C#N)C

Isomeric SMILES

CC1(CCC2=C(C1)C=C(C(=N2)SCC3=CC=CC=C3)C#N)C

InChI

InChI=1S/C19H20N2S/c1-19(2)9-8-17-15(11-19)10-16(12-20)18(21-17)22-13-14-6-4-3-5-7-14/h3-7,10H,8-9,11,13H2,1-2H3