1-[(4-propan-2-ylphenyl)amino]-3-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile

Systemtic Name: 1-[(4-propan-2-ylphenyl)amino]-3-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 1-(4-isopropylanilino)-3-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 1-(4-propan-2-ylanilino)-3-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 1-(4-propan-2-ylanilino)-3-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 1-cumidino-3-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C24H25N4+ MolecularWeight: 369.4821

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=[N+]2C3=CC=CC=C3NC2=C1C#N)NC4=CC=C(C=C4)C(C)C

Isomeric SMILES

CCCC1=CC(=[N+]2C3=CC=CC=C3NC2=C1C#N)NC4=CC=C(C=C4)C(C)C

InChI

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