6-chloranyl-3-(1-phenylethyl)-1H-benzimidazol-3-ium-2-thiol

Systemtic Name: 6-chloranyl-3-(1-phenylethyl)-1H-benzimidazol-3-ium-2-thiol Openeye Name: 6-chloro-3-(1-phenylethyl)-1H-benzimidazol-3-ium-2-thiol CAS Name: 6-chloro-3-(1-phenylethyl)-1H-benzimidazol-3-ium-2-thiol IUPAC Name: 6-chloro-3-(1-phenylethyl)-1H-benzimidazol-3-ium-2-thiol Traditional Name: 6-chloro-3-(1-phenylethyl)-1H-benzimidazol-3-ium-2-thiol Formula: C15H14ClN2S+ MolecularWeight: 289.80306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[N+]2=C(NC3=C2C=CC(=C3)Cl)S

Isomeric SMILES

CC(C1=CC=CC=C1)[N+]2=C(NC3=C2C=CC(=C3)Cl)S

InChI

InChI=1S/C15H13ClN2S/c1-10(11-5-3-2-4-6-11)18-14-8-7-12(16)9-13(14)17-15(18)19/h2-10H,1H3,(H,17,19)/p+1