1-[(4-bromophenyl)amino]-2-(2-cyanoethyl)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[(4-bromophenyl)amino]-2-(2-cyanoethyl)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-(4-bromoanilino)-2-(2-cyanoethyl)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-(4-bromoanilino)-2-(2-cyanoethyl)-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-(4-bromoanilino)-2-(2-cyanoethyl)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-(4-bromoanilino)-2-(2-cyanoethyl)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C22H16BrN5 MolecularWeight: 430.29994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC#N)NC4=CC=C(C=C4)Br)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CCC#N)NC4=CC=C(C=C4)Br)C#N

InChI

InChI=1S/C22H16BrN5/c1-14-17(5-4-12-24)21(26-16-10-8-15(23)9-11-16)28-20-7-3-2-6-19(20)27-22(28)18(14)13-25/h2-3,6-11,26H,4-5H2,1H3