5-bromanyl-N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-2-propan-2-yloxy-benzamide

Systemtic Name: 5-bromanyl-N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-2-propan-2-yloxy-benzamide Openeye Name: 5-bromo-N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-2-isopropoxy-benzamide CAS Name: 5-bromo-N-(3-cyano-2-pyrimido[1,2-a]benzimidazolyl)-2-propan-2-yloxybenzamide IUPAC Name: 5-bromo-N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-2-propan-2-yloxybenzamide Traditional Name: 5-bromo-N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-2-isopropoxy-benzamide Formula: C21H16BrN5O2 MolecularWeight: 450.28804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)Br)C(=O)NC2=NC3=NC4=CC=CC=C4N3C=C2C#N

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)Br)C(=O)NC2=NC3=NC4=CC=CC=C4N3C=C2C#N

InChI

InChI=1S/C21H16BrN5O2/c1-12(2)29-18-8-7-14(22)9-15(18)20(28)25-19-13(10-23)11-27-17-6-4-3-5-16(17)24-21(27)26-19/h3-9,11-12H,1-2H3,(H,24,25,26,28)