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

Systemtic Name: 5-[2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoyl]-1,3-diethyl-benzimidazol-2-one Openeye Name: 5-[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]propanoyl]-1,3-diethyl-benzimidazol-2-one CAS Name: 5-[2-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxopropyl]-1,3-diethyl-2-benzimidazolone IUPAC Name: 5-[2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoyl]-1,3-diethylbenzimidazol-2-one Traditional Name: 5-[2-[(4,8-dimethyl-2-quinolyl)thio]propanoyl]-1,3-diethyl-benzimidazol-2-one Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3O2S/c1-6-27-20-12-11-18(14-21(20)28(7-2)25(27)30)24(29)17(5)31-22-13-16(4)19-10-8-9-15(3)23(19)26-22/h8-14,17H,6-7H2,1-5H3