3-methyl-2-(3-methylbutyl)-1-(octylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-methyl-2-(3-methylbutyl)-1-(octylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-isopentyl-3-methyl-1-(octylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-2-(3-methylbutyl)-1-(octylamino)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-2-(3-methylbutyl)-1-(octylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-isoamyl-3-methyl-1-(octylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C26H36N4 MolecularWeight: 404.59084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CCC(C)C

Isomeric SMILES

CCCCCCCCNC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CCC(C)C

InChI

InChI=1S/C26H36N4/c1-5-6-7-8-9-12-17-28-25-21(16-15-19(2)3)20(4)22(18-27)26-29-23-13-10-11-14-24(23)30(25)26/h10-11,13-14,19,28H,5-9,12,15-17H2,1-4H3