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

Systemtic Name: 1-[(3-chloranyl-4-methyl-phenyl)amino]-3-methyl-2-(phenylmethyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-benzyl-1-(3-chloro-4-methyl-anilino)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-(3-chloro-4-methylanilino)-3-methyl-2-(phenylmethyl)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-benzyl-1-(3-chloro-4-methylanilino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-benzyl-1-(3-chloro-4-methyl-anilino)-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C27H21ClN4 MolecularWeight: 436.93544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C(C(=C(C3=NC4=CC=CC=C4N23)C#N)C)CC5=CC=CC=C5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C(C(=C(C3=NC4=CC=CC=C4N23)C#N)C)CC5=CC=CC=C5)Cl

InChI

InChI=1S/C27H21ClN4/c1-17-12-13-20(15-23(17)28)30-26-21(14-19-8-4-3-5-9-19)18(2)22(16-29)27-31-24-10-6-7-11-25(24)32(26)27/h3-13,15,30H,14H2,1-2H3