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

Systemtic Name: 3-methyl-2-(phenylmethyl)-1-(undecylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-benzyl-3-methyl-1-(undecylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-2-(phenylmethyl)-1-(undecylamino)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-benzyl-3-methyl-1-(undecylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-benzyl-3-methyl-1-(undecylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C31H38N4 MolecularWeight: 466.66022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCNC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CC4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCCNC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CC4=CC=CC=C4

InChI

InChI=1S/C31H38N4/c1-3-4-5-6-7-8-9-10-16-21-33-30-26(22-25-17-12-11-13-18-25)24(2)27(23-32)31-34-28-19-14-15-20-29(28)35(30)31/h11-15,17-20,33H,3-10,16,21-22H2,1-2H3