3-[(4-methylphenyl)methyl]-2-thiophen-2-yl-1H-benzimidazol-3-ium

Systemtic Name: 3-[(4-methylphenyl)methyl]-2-thiophen-2-yl-1H-benzimidazol-3-ium Openeye Name: 3-(p-tolylmethyl)-2-(2-thienyl)-1H-benzimidazol-3-ium CAS Name: 3-[(4-methylphenyl)methyl]-2-thiophen-2-yl-1H-benzimidazol-3-ium IUPAC Name: 3-[(4-methylphenyl)methyl]-2-thiophen-2-yl-1H-benzimidazol-3-ium Traditional Name: 3-(4-methylbenzyl)-2-(2-thienyl)-1H-benzimidazol-3-ium Formula: C19H17N2S+ MolecularWeight: 305.41668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C19H16N2S/c1-14-8-10-15(11-9-14)13-21-17-6-3-2-5-16(17)20-19(21)18-7-4-12-22-18/h2-12H,13H2,1H3/p+1