N-[4-(5-cyanopyridin-2-yl)oxy-1-imidazol-1-yl-butan-2-yl]-4-iodanyl-benzamide

Systemtic Name: N-[4-(5-cyanopyridin-2-yl)oxy-1-imidazol-1-yl-butan-2-yl]-4-iodanyl-benzamide Openeye Name: N-[3-[(5-cyano-2-pyridyl)oxy]-1-(imidazol-1-ylmethyl)propyl]-4-iodo-benzamide CAS Name: N-[4-[(5-cyano-2-pyridinyl)oxy]-1-(1-imidazolyl)butan-2-yl]-4-iodobenzamide IUPAC Name: N-[4-(5-cyanopyridin-2-yl)oxy-1-imidazol-1-ylbutan-2-yl]-4-iodobenzamide Traditional Name: N-[3-[(5-cyano-2-pyridyl)oxy]-1-(imidazol-1-ylmethyl)propyl]-4-iodo-benzamide Formula: C20H18IN5O2 MolecularWeight: 487.29369

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(CCOC2=NC=C(C=C2)C#N)CN3C=CN=C3)I

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(CCOC2=NC=C(C=C2)C#N)CN3C=CN=C3)I

InChI

InChI=1S/C20H18IN5O2/c21-17-4-2-16(3-5-17)20(27)25-18(13-26-9-8-23-14-26)7-10-28-19-6-1-15(11-22)12-24-19/h1-6,8-9,12,14,18H,7,10,13H2,(H,25,27)