4-[[3-[[6-(5-chloranyl-2-oxidanylidene-pyridin-1-yl)pyridin-3-yl]methyl]imidazol-4-yl]-oxidanyl-methyl]benzenecarbonitrile

Systemtic Name: 4-[[3-[[6-(5-chloranyl-2-oxidanylidene-pyridin-1-yl)pyridin-3-yl]methyl]imidazol-4-yl]-oxidanyl-methyl]benzenecarbonitrile Openeye Name: 4-[[3-[[6-(5-chloro-2-oxo-1-pyridyl)-3-pyridyl]methyl]imidazol-4-yl]-hydroxy-methyl]benzonitrile CAS Name: 4-[[3-[[6-(5-chloro-2-oxo-1-pyridinyl)-3-pyridinyl]methyl]-4-imidazolyl]-hydroxymethyl]benzonitrile IUPAC Name: 4-[[3-[[6-(5-chloro-2-oxopyridin-1-yl)pyridin-3-yl]methyl]imidazol-4-yl]-hydroxymethyl]benzonitrile Traditional Name: 4-[[3-[[6-(5-chloro-2-keto-1-pyridyl)-3-pyridyl]methyl]imidazol-4-yl]-hydroxy-methyl]benzonitrile Formula: C22H16ClN5O2 MolecularWeight: 417.84774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(C2=CN=CN2CC3=CN=C(C=C3)N4C=C(C=CC4=O)Cl)O

Isomeric SMILES

C1=CC(=CC=C1C#N)C(C2=CN=CN2CC3=CN=C(C=C3)N4C=C(C=CC4=O)Cl)O

InChI

InChI=1S/C22H16ClN5O2/c23-18-6-8-21(29)28(13-18)20-7-3-16(10-26-20)12-27-14-25-11-19(27)22(30)17-4-1-15(9-24)2-5-17/h1-8,10-11,13-14,22,30H,12H2