1-carbazol-9-yl-2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanone

Systemtic Name: 1-carbazol-9-yl-2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanone Openeye Name: 2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-1-carbazol-9-yl-ethanone CAS Name: 1-(9-carbazolyl)-2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]thio]ethanone IUPAC Name: 2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-1-carbazol-9-ylethanone Traditional Name: 2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)thio]-1-carbazol-9-yl-ethanone Formula: C28H22N3OS+ MolecularWeight: 448.55878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)SCC(=O)N4C5=CC=CC=C5C6=CC=CC=C64

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)SCC(=O)N4C5=CC=CC=C5C6=CC=CC=C64

InChI

InChI=1S/C28H21N3OS/c32-27(31-24-15-7-4-12-21(24)22-13-5-8-16-25(22)31)19-33-28-29-23-14-6-9-17-26(23)30(28)18-20-10-2-1-3-11-20/h1-17H,18-19H2/p+1