1-[(3-cyano-4-methoxy-phenyl)methyl]-3-(4-oxidanylcyclohexyl)-2-oxidanylidene-imidazo[4,5-b]pyridine-6-carbonitrile

Systemtic Name: 1-[(3-cyano-4-methoxy-phenyl)methyl]-3-(4-oxidanylcyclohexyl)-2-oxidanylidene-imidazo[4,5-b]pyridine-6-carbonitrile Openeye Name: 1-[(3-cyano-4-methoxy-phenyl)methyl]-3-(4-hydroxycyclohexyl)-2-oxo-imidazo[4,5-b]pyridine-6-carbonitrile CAS Name: 1-[(3-cyano-4-methoxyphenyl)methyl]-3-(4-hydroxycyclohexyl)-2-oxo-6-imidazo[4,5-b]pyridinecarbonitrile IUPAC Name: 1-[(3-cyano-4-methoxyphenyl)methyl]-3-(4-hydroxycyclohexyl)-2-oxoimidazo[4,5-b]pyridine-6-carbonitrile Traditional Name: 1-(3-cyano-4-methoxy-benzyl)-3-(4-hydroxycyclohexyl)-2-keto-imidazo[4,5-b]pyridine-6-carbonitrile Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C3=C(N=CC(=C3)C#N)N(C2=O)C4CCC(CC4)O)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C3=C(N=CC(=C3)C#N)N(C2=O)C4CCC(CC4)O)C#N

InChI

InChI=1S/C22H21N5O3/c1-30-20-7-2-14(8-16(20)11-24)13-26-19-9-15(10-23)12-25-21(19)27(22(26)29)17-3-5-18(28)6-4-17/h2,7-9,12,17-18,28H,3-6,13H2,1H3