2-ethyl-3-methyl-1-(2-piperazin-4-ium-1-ylethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 2-ethyl-3-methyl-1-(2-piperazin-4-ium-1-ylethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-ethyl-3-methyl-1-(2-piperazin-4-ium-1-ylethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 2-ethyl-3-methyl-1-[2-(1-piperazin-4-iumyl)ethylamino]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-ethyl-3-methyl-1-(2-piperazin-4-ium-1-ylethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-ethyl-3-methyl-1-(2-piperazin-4-ium-1-ylethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C21H27N6+ MolecularWeight: 363.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NCCN4CC[NH2+]CC4

Isomeric SMILES

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NCCN4CC[NH2+]CC4

InChI

InChI=1S/C21H26N6/c1-3-16-15(2)17(14-22)21-25-18-6-4-5-7-19(18)27(21)20(16)24-10-13-26-11-8-23-9-12-26/h4-7,23-24H,3,8-13H2,1-2H3/p+1