3-methyl-2-[(2-methylphenyl)methyl]-1-(3-morpholin-4-ylpropylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-methyl-2-[(2-methylphenyl)methyl]-1-(3-morpholin-4-ylpropylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-(3-morpholinopropylamino)-2-(o-tolylmethyl)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-2-[(2-methylphenyl)methyl]-1-[3-(4-morpholinyl)propylamino]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-2-[(2-methylphenyl)methyl]-1-(3-morpholin-4-ylpropylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-methyl-2-(2-methylbenzyl)-1-(3-morpholinopropylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C28H31N5O MolecularWeight: 453.57864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2=C(N3C4=CC=CC=C4N=C3C(=C2C)C#N)NCCCN5CCOCC5

Isomeric SMILES

CC1=CC=CC=C1CC2=C(N3C4=CC=CC=C4N=C3C(=C2C)C#N)NCCCN5CCOCC5

InChI

InChI=1S/C28H31N5O/c1-20-8-3-4-9-22(20)18-23-21(2)24(19-29)28-31-25-10-5-6-11-26(25)33(28)27(23)30-12-7-13-32-14-16-34-17-15-32/h3-6,8-11,30H,7,12-18H2,1-2H3