1-(2,2,4,6,8-pentamethylquinolin-1-yl)-2-(4-phenylsulfanylphenyl)sulfanyl-ethanone

Systemtic Name: 1-(2,2,4,6,8-pentamethylquinolin-1-yl)-2-(4-phenylsulfanylphenyl)sulfanyl-ethanone Openeye Name: 1-(2,2,4,6,8-pentamethyl-1-quinolyl)-2-(4-phenylsulfanylphenyl)sulfanyl-ethanone CAS Name: 1-(2,2,4,6,8-pentamethyl-1-quinolinyl)-2-[[4-(phenylthio)phenyl]thio]ethanone IUPAC Name: 1-(2,2,4,6,8-pentamethylquinolin-1-yl)-2-(4-phenylsulfanylphenyl)sulfanylethanone Traditional Name: 1-(2,2,4,6,8-pentamethyl-1-quinolyl)-2-[[4-(phenylthio)phenyl]thio]ethanone Formula: C28H29NOS2 MolecularWeight: 459.66596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(N2C(=O)CSC3=CC=C(C=C3)SC4=CC=CC=C4)(C)C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(N2C(=O)CSC3=CC=C(C=C3)SC4=CC=CC=C4)(C)C)C)C

InChI

InChI=1S/C28H29NOS2/c1-19-15-20(2)27-25(16-19)21(3)17-28(4,5)29(27)26(30)18-31-22-11-13-24(14-12-22)32-23-9-7-6-8-10-23/h6-17H,18H2,1-5H3