methyl 2-[[2-(6-fluoranylpyridin-2-yl)imidazol-1-yl]methyl]-3-propyl-benzimidazole-5-carboxylate

Systemtic Name: methyl 2-[[2-(6-fluoranylpyridin-2-yl)imidazol-1-yl]methyl]-3-propyl-benzimidazole-5-carboxylate Openeye Name: methyl 2-[[2-(6-fluoro-2-pyridyl)imidazol-1-yl]methyl]-3-propyl-benzimidazole-5-carboxylate CAS Name: 2-[[2-(6-fluoro-2-pyridinyl)-1-imidazolyl]methyl]-3-propyl-5-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(6-fluoropyridin-2-yl)imidazol-1-yl]methyl]-3-propylbenzimidazole-5-carboxylate Traditional Name: 2-[[2-(6-fluoro-2-pyridyl)imidazol-1-yl]methyl]-3-propyl-benzimidazole-5-carboxylic acid methyl ester Formula: C21H20FN5O2 MolecularWeight: 393.414203

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)C(=O)OC)N=C1CN3C=CN=C3C4=NC(=CC=C4)F

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)C(=O)OC)N=C1CN3C=CN=C3C4=NC(=CC=C4)F

InChI

InChI=1S/C21H20FN5O2/c1-3-10-27-17-12-14(21(28)29-2)7-8-15(17)25-19(27)13-26-11-9-23-20(26)16-5-4-6-18(22)24-16/h4-9,11-12H,3,10,13H2,1-2H3