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

Systemtic Name: 2-[(2-chlorophenyl)methyl]-3-methyl-1-(pentylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-[(2-chlorophenyl)methyl]-3-methyl-1-(pentylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 2-[(2-chlorophenyl)methyl]-3-methyl-1-(pentylamino)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-[(2-chlorophenyl)methyl]-3-methyl-1-(pentylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-(amylamino)-2-(2-chlorobenzyl)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C25H25ClN4 MolecularWeight: 416.9458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CC4=CC=CC=C4Cl

Isomeric SMILES

CCCCCNC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CC4=CC=CC=C4Cl

InChI

InChI=1S/C25H25ClN4/c1-3-4-9-14-28-24-19(15-18-10-5-6-11-21(18)26)17(2)20(16-27)25-29-22-12-7-8-13-23(22)30(24)25/h5-8,10-13,28H,3-4,9,14-15H2,1-2H3