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

Systemtic Name: 5-[2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoyl]-1,3-dihydrobenzimidazol-2-one Openeye Name: 5-[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]propanoyl]-1,3-dihydrobenzimidazol-2-one CAS Name: 5-[2-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxopropyl]-1,3-dihydrobenzimidazol-2-one IUPAC Name: 5-[2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoyl]-1,3-dihydrobenzimidazol-2-one Traditional Name: 5-[2-[(4,8-dimethyl-2-quinolyl)thio]propanoyl]-1,3-dihydrobenzimidazol-2-one Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SC(C)C(=O)C3=CC4=C(C=C3)NC(=O)N4

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SC(C)C(=O)C3=CC4=C(C=C3)NC(=O)N4

InChI

InChI=1S/C21H19N3O2S/c1-11-5-4-6-15-12(2)9-18(24-19(11)15)27-13(3)20(25)14-7-8-16-17(10-14)23-21(26)22-16/h4-10,13H,1-3H3,(H2,22,23,26)