2-ethyl-3-methyl-1-[4-(2-methylphenyl)piperazin-1-yl]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile

Systemtic Name: 2-ethyl-3-methyl-1-[4-(2-methylphenyl)piperazin-1-yl]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 2-ethyl-3-methyl-1-[4-(o-tolyl)piperazin-1-yl]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 2-ethyl-3-methyl-1-[4-(2-methylphenyl)-1-piperazinyl]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 2-ethyl-3-methyl-1-[4-(2-methylphenyl)piperazin-1-yl]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 2-ethyl-3-methyl-1-[4-(o-tolyl)piperazino]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C26H28N5+ MolecularWeight: 410.53402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)N4CCN(CC4)C5=CC=CC=C5C

Isomeric SMILES

CCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)N4CCN(CC4)C5=CC=CC=C5C

InChI

InChI=1S/C26H27N5/c1-4-20-19(3)21(17-27)25-28-22-10-6-8-12-24(22)31(25)26(20)30-15-13-29(14-16-30)23-11-7-5-9-18(23)2/h5-12H,4,13-16H2,1-3H3/p+1