methyl 6-[6-(6-bromanyl-1H-benzimidazol-2-yl)pyridin-3-yl]-5-chloranyl-pyridine-3-carboxylate

Systemtic Name: methyl 6-[6-(6-bromanyl-1H-benzimidazol-2-yl)pyridin-3-yl]-5-chloranyl-pyridine-3-carboxylate Openeye Name: methyl 6-[6-(6-bromo-1H-benzimidazol-2-yl)-3-pyridyl]-5-chloro-pyridine-3-carboxylate CAS Name: 6-[6-(6-bromo-1H-benzimidazol-2-yl)-3-pyridinyl]-5-chloro-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[6-(6-bromo-1H-benzimidazol-2-yl)pyridin-3-yl]-5-chloropyridine-3-carboxylate Traditional Name: 6-[6-(6-bromo-1H-benzimidazol-2-yl)-3-pyridyl]-5-chloro-nicotinic acid methyl ester Formula: C19H12BrClN4O2 MolecularWeight: 443.68118

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(N=C1)C2=CN=C(C=C2)C3=NC4=C(N3)C=C(C=C4)Br)Cl

Isomeric SMILES

COC(=O)C1=CC(=C(N=C1)C2=CN=C(C=C2)C3=NC4=C(N3)C=C(C=C4)Br)Cl

InChI

InChI=1S/C19H12BrClN4O2/c1-27-19(26)11-6-13(21)17(23-9-11)10-2-4-15(22-8-10)18-24-14-5-3-12(20)7-16(14)25-18/h2-9H,1H3,(H,24,25)