1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanone

Systemtic Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanone Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanone CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]ethanone IUPAC Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanone Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]ethanone Formula: C19H20N3OS+ MolecularWeight: 338.4466

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=CC=CC=C21)SCC(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

C[N+]1=C(NC2=CC=CC=C21)SCC(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C19H19N3OS/c1-21-17-11-5-3-9-15(17)20-19(21)24-13-18(23)22-12-6-8-14-7-2-4-10-16(14)22/h2-5,7,9-11H,6,8,12-13H2,1H3/p+1