Hydroxide → HCID 24958698, compound

HRID 2143388Notes

Reaction equation

HRID 2143388 reaction equation
[C:1](=[O:2])([CH3:3])[O:4][CH2:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([c:14]2[c:15]([C:37]#[N:38])[c:16]([NH2:36])[n:17][c:18]([S:22][CH2:23][c:24]3[n:25][c:26](-[c:29]4[cH:30][cH:31][c:32]([Cl:35])[cH:33][cH:34]4)[s:27][cH:28]3)[c:19]2[C:20]#[N:21])[CH2:12][CH2:13]1.[Li+:39].[O:41]1[CH2:42][CH2:43][O:44][CH2:45][CH2:46]1.[OH-:40].[OH2:47]>>[OH:4][CH2:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([c:14]2[c:15]([C:37]#[N:38])[c:16]([NH2:36])[n:17][c:18]([S:22][CH2:23][c:24]3[n:25][c:26](-[c:29]4[cH:30][cH:31][c:32]([Cl:35])[cH:33][cH:34]4)[s:27][cH:28]3)[c:19]2[C:20]#[N:21])[CH2:12][CH2:13]1

Participants

6

Reactant 5

HCID 961HydroxideHCID 962WaterHCID 28486Lithium ionHCID 312751,4-DioxaneHCID 687021312-{4-[2-Amino-6-({[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl}thio)-3,5-dicyanopyridin-4-yl]-piperidin-1-yl}-2-oxoethyl acetate

Product 1

HCID 24958698HCID 24958698, compound

Sources & evidence

ORD record
ord-0bbda6837b614d41b22ed7f7b18b0c02
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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