5-[2-[(4-bromophenyl)amino]-1-methyl-benzimidazol-5-yl]oxy-N-methyl-pyridine-3-carboxamide

Systemtic Name: 5-[2-[(4-bromophenyl)amino]-1-methyl-benzimidazol-5-yl]oxy-N-methyl-pyridine-3-carboxamide Openeye Name: 5-[2-(4-bromoanilino)-1-methyl-benzimidazol-5-yl]oxy-N-methyl-pyridine-3-carboxamide CAS Name: 5-[[2-(4-bromoanilino)-1-methyl-5-benzimidazolyl]oxy]-N-methyl-3-pyridinecarboxamide IUPAC Name: 5-[2-(4-bromoanilino)-1-methylbenzimidazol-5-yl]oxy-N-methylpyridine-3-carboxamide Traditional Name: 5-[2-(4-bromoanilino)-1-methyl-benzimidazol-5-yl]oxy-N-methyl-nicotinamide Formula: C21H18BrN5O2 MolecularWeight: 452.30392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CN=C1)OC2=CC3=C(C=C2)N(C(=N3)NC4=CC=C(C=C4)Br)C

Isomeric SMILES

CNC(=O)C1=CC(=CN=C1)OC2=CC3=C(C=C2)N(C(=N3)NC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C21H18BrN5O2/c1-23-20(28)13-9-17(12-24-11-13)29-16-7-8-19-18(10-16)26-21(27(19)2)25-15-5-3-14(22)4-6-15/h3-12H,1-2H3,(H,23,28)(H,25,26)