Acetic Acid → HCID 73863235, compound

HRID 177488Notes

Reaction equation

HRID 177488 reaction equation
[CH2:43]1[CH2:44][CH2:45][NH:46][CH2:47][CH2:48]1.[CH3:49][C:50](=[O:51])[OH:52].[CH:1]([CH3:2])([CH3:3])[c:4]1[n:5][c:6]([CH2:9][CH2:10][c:11]2[cH:12][c:13]3[n:14]([c:15](=[O:27])[c:16]([CH:25]=[O:26])[c:17]([N:19]4[CH2:20][CH2:21][O:22][CH2:23][CH2:24]4)[n:18]3)[cH:28][cH:29]2)[s:7][cH:8]1.[S:30]1[C:31](=[O:36])[NH:32][C:33](=[O:35])[CH2:34]1.[cH:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[CH:1]([CH3:2])([CH3:3])[c:4]1[n:5][c:6]([CH2:9][CH2:10][c:11]2[cH:12][c:13]3[n:14]([c:15](=[O:27])[c:16]([CH:25]=[C:34]4[S:30][C:31](=[O:36])[NH:32][C:33]4=[O:35])[c:17]([N:19]4[CH2:20][CH2:21][O:22][CH2:23][CH2:24]4)[n:18]3)[cH:28][cH:29]2)[s:7][cH:8]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 241BenzeneHCID 5437ThiazolidinedioneHCID 8082PiperidineHCID 22063658HCID 22063658, compound

Product 1

HCID 73863235HCID 73863235, compound

Sources & evidence

ORD record
ord-d952ff63befb4076aebbe6d447d9c20c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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