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

Systemtic Name: 2-butyl-1-[[4-(diethylamino)phenyl]amino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 2-butyl-1-[4-(diethylamino)anilino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 2-butyl-1-[4-(diethylamino)anilino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 2-butyl-1-[4-(diethylamino)anilino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 2-butyl-1-[4-(diethylamino)anilino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C27H32N5+ MolecularWeight: 426.57648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)NC4=CC=C(C=C4)N(CC)CC

Isomeric SMILES

CCCCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)NC4=CC=C(C=C4)N(CC)CC

InChI

InChI=1S/C27H31N5/c1-5-8-11-22-19(4)23(18-28)27-30-24-12-9-10-13-25(24)32(27)26(22)29-20-14-16-21(17-15-20)31(6-2)7-3/h9-10,12-17H,5-8,11H2,1-4H3,(H,29,30)/p+1