N-[4-(3-cyanopyridin-2-yl)oxy-1-imidazol-1-yl-butan-2-yl]-4-iodanyl-benzamide

Systemtic Name: N-[4-(3-cyanopyridin-2-yl)oxy-1-imidazol-1-yl-butan-2-yl]-4-iodanyl-benzamide Openeye Name: N-[3-[(3-cyano-2-pyridyl)oxy]-1-(imidazol-1-ylmethyl)propyl]-4-iodo-benzamide CAS Name: N-[4-[(3-cyano-2-pyridinyl)oxy]-1-(1-imidazolyl)butan-2-yl]-4-iodobenzamide IUPAC Name: N-[4-(3-cyanopyridin-2-yl)oxy-1-imidazol-1-ylbutan-2-yl]-4-iodobenzamide Traditional Name: N-[3-[(3-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(=C(N=C1)OCCC(CN2C=CN=C2)NC(=O)C3=CC=C(C=C3)I)C#N

Isomeric SMILES

C1=CC(=C(N=C1)OCCC(CN2C=CN=C2)NC(=O)C3=CC=C(C=C3)I)C#N

InChI

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