N-[4-[2-[(4-bromophenyl)amino]-1-methyl-benzimidazol-5-yl]oxypyridin-2-yl]-4-ethyl-pyridin-1-ium-1-carboxamide

Systemtic Name: N-[4-[2-[(4-bromophenyl)amino]-1-methyl-benzimidazol-5-yl]oxypyridin-2-yl]-4-ethyl-pyridin-1-ium-1-carboxamide Openeye Name: N-[4-[2-(4-bromoanilino)-1-methyl-benzimidazol-5-yl]oxy-2-pyridyl]-4-ethyl-pyridin-1-ium-1-carboxamide CAS Name: N-[4-[[2-(4-bromoanilino)-1-methyl-5-benzimidazolyl]oxy]-2-pyridinyl]-4-ethyl-1-pyridin-1-iumcarboxamide IUPAC Name: N-[4-[2-(4-bromoanilino)-1-methylbenzimidazol-5-yl]oxypyridin-2-yl]-4-ethylpyridin-1-ium-1-carboxamide Traditional Name: N-[4-[2-(4-bromoanilino)-1-methyl-benzimidazol-5-yl]oxy-2-pyridyl]-4-ethyl-pyridin-1-ium-1-carboxamide Formula: C27H24BrN6O2+ MolecularWeight: 544.42246

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=[N+](C=C1)C(=O)NC2=NC=CC(=C2)OC3=CC4=C(C=C3)N(C(=N4)NC5=CC=C(C=C5)Br)C

Isomeric SMILES

CCC1=CC=[N+](C=C1)C(=O)NC2=NC=CC(=C2)OC3=CC4=C(C=C3)N(C(=N4)NC5=CC=C(C=C5)Br)C

InChI

InChI=1S/C27H23BrN6O2/c1-3-18-11-14-34(15-12-18)27(35)32-25-17-22(10-13-29-25)36-21-8-9-24-23(16-21)31-26(33(24)2)30-20-6-4-19(28)5-7-20/h4-17H,3H2,1-2H3,(H-,29,30,31,32,35)/p+1