2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-1-(4-phenylphenyl)ethanone

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-1-(4-phenylphenyl)ethanone Openeye Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-1-(4-phenylphenyl)ethanone CAS Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)thio]-1-(4-phenylphenyl)ethanone IUPAC Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-1-(4-phenylphenyl)ethanone Traditional Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)thio]-1-(4-phenylphenyl)ethanone Formula: C22H19N2OS+ MolecularWeight: 359.46406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[NH+]=C(N2)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)[NH+]=C(N2)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2OS/c1-15-7-12-19-20(13-15)24-22(23-19)26-14-21(25)18-10-8-17(9-11-18)16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,23,24)/p+1