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

Systemtic Name: 3-methyl-1-(octadecylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-(octadecylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-1-(octadecylamino)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-1-(octadecylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-methyl-1-(stearylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C31H46N4 MolecularWeight: 474.72374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC1=CC(=C(C2=NC3=CC=CC=C3N12)C#N)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC1=CC(=C(C2=NC3=CC=CC=C3N12)C#N)C

InChI

InChI=1S/C31H46N4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-33-30-24-26(2)27(25-32)31-34-28-21-18-19-22-29(28)35(30)31/h18-19,21-22,24,33H,3-17,20,23H2,1-2H3