2-butyl-3-methyl-1-[(phenylmethyl)amino]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile

Systemtic Name: 2-butyl-3-methyl-1-[(phenylmethyl)amino]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 1-(benzylamino)-2-butyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 2-butyl-3-methyl-1-[(phenylmethyl)amino]-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 1-(benzylamino)-2-butyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 1-(benzylamino)-2-butyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C24H25N4+ MolecularWeight: 369.4821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)NCC4=CC=CC=C4

Isomeric SMILES

CCCCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)NCC4=CC=CC=C4

InChI

InChI=1S/C24H24N4/c1-3-4-12-19-17(2)20(15-25)24-27-21-13-8-9-14-22(21)28(24)23(19)26-16-18-10-6-5-7-11-18/h5-11,13-14H,3-4,12,16H2,1-2H3,(H,26,27)/p+1