6-(2-methylbutan-2-yl)-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 6-(2-methylbutan-2-yl)-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 6-(1,1-dimethylpropyl)-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 6-(2-methylbutan-2-yl)-2-[[2-oxo-2-(4-phenylphenyl)ethyl]thio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 6-(2-methylbutan-2-yl)-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 6-tert-amyl-2-[[2-keto-2-(4-phenylphenyl)ethyl]thio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C29H30N2OS MolecularWeight: 454.6263

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C1)C=C(C(=N2)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CCC(C)(C)C1CCC2=C(C1)C=C(C(=N2)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C29H30N2OS/c1-4-29(2,3)25-14-15-26-23(17-25)16-24(18-30)28(31-26)33-19-27(32)22-12-10-21(11-13-22)20-8-6-5-7-9-20/h5-13,16,25H,4,14-15,17,19H2,1-3H3