2-[3-(1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-(2,2,4,7-tetramethylquinolin-1-yl)ethanone

Systemtic Name: 2-[3-(1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-(2,2,4,7-tetramethylquinolin-1-yl)ethanone Openeye Name: 2-[[3-(1H-benzimidazol-2-yl)-2-pyridyl]sulfanyl]-1-(2,2,4,7-tetramethyl-1-quinolyl)ethanone CAS Name: 2-[[3-(1H-benzimidazol-2-yl)-2-pyridinyl]thio]-1-(2,2,4,7-tetramethyl-1-quinolinyl)ethanone IUPAC Name: 2-[3-(1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-(2,2,4,7-tetramethylquinolin-1-yl)ethanone Traditional Name: 2-[[3-(1H-benzimidazol-2-yl)-2-pyridyl]thio]-1-(2,2,4,7-tetramethyl-1-quinolyl)ethanone Formula: C27H26N4OS MolecularWeight: 454.58654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(N2C(=O)CSC3=C(C=CC=N3)C4=NC5=CC=CC=C5N4)(C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(N2C(=O)CSC3=C(C=CC=N3)C4=NC5=CC=CC=C5N4)(C)C)C

InChI

InChI=1S/C27H26N4OS/c1-17-11-12-19-18(2)15-27(3,4)31(23(19)14-17)24(32)16-33-26-20(8-7-13-28-26)25-29-21-9-5-6-10-22(21)30-25/h5-15H,16H2,1-4H3,(H,29,30)