tert-butyl 4-[2-[(4-bromophenyl)amino]-1-methyl-benzimidazol-5-yl]oxypyridine-2-carboxylate

Systemtic Name: tert-butyl 4-[2-[(4-bromophenyl)amino]-1-methyl-benzimidazol-5-yl]oxypyridine-2-carboxylate Openeye Name: tert-butyl 4-[2-(4-bromoanilino)-1-methyl-benzimidazol-5-yl]oxypyridine-2-carboxylate CAS Name: 4-[[2-(4-bromoanilino)-1-methyl-5-benzimidazolyl]oxy]-2-pyridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(4-bromoanilino)-1-methylbenzimidazol-5-yl]oxypyridine-2-carboxylate Traditional Name: 4-[2-(4-bromoanilino)-1-methyl-benzimidazol-5-yl]oxypicolinic acid tert-butyl ester Formula: C24H23BrN4O3 MolecularWeight: 495.36842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23BrN4O3/c1-24(2,3)32-22(30)20-14-18(11-12-26-20)31-17-9-10-21-19(13-17)28-23(29(21)4)27-16-7-5-15(25)6-8-16/h5-14H,1-4H3,(H,27,28)