Ethyl Acetoacetate → HCID 66746512, compound

HRID 2047871Notes

Reaction equation

[NH2:1][C:2]1[CH:9]=[CH:8][CH:7]=[C:6]([O:10][C@@H:11]2[CH2:16][C@H:15]([CH3:17])[CH2:14][CH2:13][C@H:12]2[CH:18]([CH3:20])[CH3:19])[C:3]=1[C:4]#[N:5].O=[C:22]([CH3:29])[CH2:23][C:24]([O:26][CH2:27][CH3:28])=[O:25]>>[CH2:27]([O:26][C:24]([C:23]1[C:22]([CH3:29])=[N:1][C:2]2[C:3]([C:4]=1[NH2:5])=[C:6]([O:10][C@@H:11]1[CH2:16][C@H:15]([CH3:17])[CH2:14][CH2:13][C@H:12]1[CH:18]([CH3:20])[CH3:19])[CH:7]=[CH:8][CH:9]=2)=[O:25])[CH3:28]

Participants

Reactant 2

HCID 8868Ethyl Acetoacetate

HCID 66746507HCID 66746507, compound

Product 1

HCID 66746512HCID 66746512, compound

Procedure

Prepared as in Example 2a from 2-amino-6-(((1R,2S,5R)-2-isopropyl-5-methylcyclohexyl)oxy)benzonitrile (Example 122b) and ethyl 3-oxobutanoate as a pale yellow solid (43%). MS 385 (MH+).

Sources & evidence

ORD record: ord-094ed034e29f452588166080ad708c7f
Source dataset: uspto-grants-2013_11
DOI: 10.6084/m9.figshare.5104873.v1
Patent number: US08592592B2

Reaction notes

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