N-[[4-[2-[(4-bromophenyl)amino]-1-methyl-benzimidazol-5-yl]oxypyridin-2-yl]methyl]ethanamide

Systemtic Name: N-[[4-[2-[(4-bromophenyl)amino]-1-methyl-benzimidazol-5-yl]oxypyridin-2-yl]methyl]ethanamide Openeye Name: N-[[4-[2-(4-bromoanilino)-1-methyl-benzimidazol-5-yl]oxy-2-pyridyl]methyl]acetamide CAS Name: N-[[4-[[2-(4-bromoanilino)-1-methyl-5-benzimidazolyl]oxy]-2-pyridinyl]methyl]acetamide IUPAC Name: N-[[4-[2-(4-bromoanilino)-1-methylbenzimidazol-5-yl]oxypyridin-2-yl]methyl]acetamide Traditional Name: N-[[4-[2-(4-bromoanilino)-1-methyl-benzimidazol-5-yl]oxy-2-pyridyl]methyl]acetamide Formula: C22H20BrN5O2 MolecularWeight: 466.3305

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=NC=CC(=C1)OC2=CC3=C(C=C2)N(C(=N3)NC4=CC=C(C=C4)Br)C

Isomeric SMILES

CC(=O)NCC1=NC=CC(=C1)OC2=CC3=C(C=C2)N(C(=N3)NC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C22H20BrN5O2/c1-14(29)25-13-17-11-19(9-10-24-17)30-18-7-8-21-20(12-18)27-22(28(21)2)26-16-5-3-15(23)4-6-16/h3-12H,13H2,1-2H3,(H,25,29)(H,26,27)