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

Systemtic Name: 3-methyl-2-prop-2-enyl-1-(undecylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-allyl-3-methyl-1-(undecylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-2-prop-2-enyl-1-(undecylamino)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-2-prop-2-enyl-1-(undecylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-allyl-3-methyl-1-(undecylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C27H36N4 MolecularWeight: 416.60154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H36N4/c1-4-6-7-8-9-10-11-12-15-19-29-26-22(16-5-2)21(3)23(20-28)27-30-24-17-13-14-18-25(24)31(26)27/h5,13-14,17-18,29H,2,4,6-12,15-16,19H2,1,3H3