1-(azepan-1-yl)-3-methyl-2-(phenylmethyl)pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-(azepan-1-yl)-3-methyl-2-(phenylmethyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-(azepan-1-yl)-2-benzyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-(1-azepanyl)-3-methyl-2-(phenylmethyl)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-(azepan-1-yl)-2-benzyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-(azepan-1-yl)-2-benzyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C26H26N4 MolecularWeight: 394.51144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC4=CC=CC=C4)N5CCCCCC5)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC4=CC=CC=C4)N5CCCCCC5)C#N

InChI

InChI=1S/C26H26N4/c1-19-21(17-20-11-5-4-6-12-20)26(29-15-9-2-3-10-16-29)30-24-14-8-7-13-23(24)28-25(30)22(19)18-27/h4-8,11-14H,2-3,9-10,15-17H2,1H3