2-[[4-cyano-3-methyl-2-[(4-methylphenyl)methyl]pyrido[1,2-a]benzimidazol-1-yl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[4-cyano-3-methyl-2-[(4-methylphenyl)methyl]pyrido[1,2-a]benzimidazol-1-yl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[4-cyano-3-methyl-2-(p-tolylmethyl)pyrido[1,2-a]benzimidazol-1-yl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[4-cyano-3-methyl-2-[(4-methylphenyl)methyl]-1-pyrido[1,2-a]benzimidazolyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[4-cyano-3-methyl-2-[(4-methylphenyl)methyl]pyrido[1,2-a]benzimidazol-1-yl]amino]ethyl-dimethylazanium Traditional Name: 2-[[4-cyano-3-methyl-2-(4-methylbenzyl)pyrido[1,2-a]benzimidazol-1-yl]amino]ethyl-dimethyl-ammonium Formula: C25H28N5+ MolecularWeight: 398.52332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=C(N3C4=CC=CC=C4N=C3C(=C2C)C#N)NCC[NH+](C)C

Isomeric SMILES

CC1=CC=C(C=C1)CC2=C(N3C4=CC=CC=C4N=C3C(=C2C)C#N)NCC[NH+](C)C

InChI

InChI=1S/C25H27N5/c1-17-9-11-19(12-10-17)15-20-18(2)21(16-26)25-28-22-7-5-6-8-23(22)30(25)24(20)27-13-14-29(3)4/h5-12,27H,13-15H2,1-4H3/p+1