1,3-diethyl-5-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylpropanoyl]benzimidazol-2-one

Systemtic Name: 1,3-diethyl-5-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylpropanoyl]benzimidazol-2-one Openeye Name: 1,3-diethyl-5-[2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]propanoyl]benzimidazol-2-one CAS Name: 1,3-diethyl-5-[1-oxo-2-[(4,6,8-trimethyl-2-quinolinyl)thio]propyl]-2-benzimidazolone IUPAC Name: 1,3-diethyl-5-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylpropanoyl]benzimidazol-2-one Traditional Name: 1,3-diethyl-5-[2-[(4,6,8-trimethyl-2-quinolyl)thio]propanoyl]benzimidazol-2-one Formula: C26H29N3O2S MolecularWeight: 447.59236

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)C(C)SC3=NC4=C(C=C(C=C4C(=C3)C)C)C)N(C1=O)CC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)C(C)SC3=NC4=C(C=C(C=C4C(=C3)C)C)C)N(C1=O)CC

InChI

InChI=1S/C26H29N3O2S/c1-7-28-21-10-9-19(14-22(21)29(8-2)26(28)31)25(30)18(6)32-23-13-16(4)20-12-15(3)11-17(5)24(20)27-23/h9-14,18H,7-8H2,1-6H3