4-(2-methylpropyl)-2-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 4-(2-methylpropyl)-2-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 4-isobutyl-2-[2-(2-naphthyl)-2-oxo-ethyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 4-(2-methylpropyl)-2-[[2-(2-naphthalenyl)-2-oxoethyl]thio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 4-(2-methylpropyl)-2-(2-naphthalen-2-yl-2-oxoethyl)sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 4-isobutyl-2-[[2-keto-2-(2-naphthyl)ethyl]thio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C26H26N2OS MolecularWeight: 414.56244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C(=NC2=C1CCCC2)SCC(=O)C3=CC4=CC=CC=C4C=C3)C#N

Isomeric SMILES

CC(C)CC1=C(C(=NC2=C1CCCC2)SCC(=O)C3=CC4=CC=CC=C4C=C3)C#N

InChI

InChI=1S/C26H26N2OS/c1-17(2)13-22-21-9-5-6-10-24(21)28-26(23(22)15-27)30-16-25(29)20-12-11-18-7-3-4-8-19(18)14-20/h3-4,7-8,11-12,14,17H,5-6,9-10,13,16H2,1-2H3