1-azanyl-3-(3-bromanyl-4,5-dimethoxy-phenyl)pyrido[1,2-a]benzimidazole-2,4-dicarbonitrile

Systemtic Name: 1-azanyl-3-(3-bromanyl-4,5-dimethoxy-phenyl)pyrido[1,2-a]benzimidazole-2,4-dicarbonitrile Openeye Name: 1-amino-3-(3-bromo-4,5-dimethoxy-phenyl)pyrido[1,2-a]benzimidazole-2,4-dicarbonitrile CAS Name: 1-amino-3-(3-bromo-4,5-dimethoxyphenyl)pyrido[1,2-a]benzimidazole-2,4-dicarbonitrile IUPAC Name: 1-amino-3-(3-bromo-4,5-dimethoxyphenyl)pyrido[1,2-a]benzimidazole-2,4-dicarbonitrile Traditional Name: 1-amino-3-(3-bromo-4,5-dimethoxy-phenyl)pyrido[1,2-a]benzimidazole-2,4-dicarbonitrile Formula: C21H14BrN5O2 MolecularWeight: 448.27216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=C(C3=NC4=CC=CC=C4N3C(=C2C#N)N)C#N)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=C(C3=NC4=CC=CC=C4N3C(=C2C#N)N)C#N)Br)OC

InChI

InChI=1S/C21H14BrN5O2/c1-28-17-8-11(7-14(22)19(17)29-2)18-12(9-23)20(25)27-16-6-4-3-5-15(16)26-21(27)13(18)10-24/h3-8H,25H2,1-2H3