Hydroxide → HCID 59434148, compound

HRID 2342655Notes

Reaction equation

HRID 2342655 reaction equation
[CH3:63][N:64]([CH3:65])[CH:66]=[O:67].[CH3:68][CH2:69][O:70][C:71](=[O:72])[CH3:73].[Li+:62].[O:1]=[S:2]1(=[O:54])[CH2:3][CH2:4][CH:5]([CH2:8][O:9][c:10]2[cH:11][c:12]([CH3:53])[c:13](-[c:17]3[cH:18][c:19]([CH2:23][N:24]([c:25]4[cH:26][c:27]([F:40])[c:28]([CH2:31][CH2:32][C:33](=[O:34])[O:35][C:36]([CH3:37])([CH3:38])[CH3:39])[cH:29][cH:30]4)[S:41]([c:42]4[cH:43][cH:44][cH:45][cH:46][c:47]4[N+:48]([O-:49])=[O:50])(=[O:51])=[O:52])[cH:20][cH:21][cH:22]3)[c:14]([CH3:16])[cH:15]2)[CH2:6][CH2:7]1.[OH-:61].[OH2:60].[SH:55][CH2:56][C:57]([OH:58])=[O:59]>>[O:1]=[S:2]1(=[O:54])[CH2:3][CH2:4][CH:5]([CH2:8][O:9][c:10]2[cH:11][c:12]([CH3:53])[c:13](-[c:17]3[cH:18][c:19]([CH2:23][NH:24][c:25]4[cH:26][c:27]([F:40])[c:28]([CH2:31][CH2:32][C:33](=[O:34])[O:35][C:36]([CH3:37])([CH3:38])[CH3:39])[cH:29][cH:30]4)[cH:20][cH:21][cH:22]3)[c:14]([CH3:16])[cH:15]2)[CH2:6][CH2:7]1

Participants

8

Reactant 7

HCID 961HydroxideHCID 962WaterHCID 1133Thioglycolic AcidHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 28486Lithium ionHCID 68720217HCID 68720217, compound

Product 1

HCID 59434148HCID 59434148, compound

Sources & evidence

ORD record
ord-dfbb86700ded4619b29fc6ad8dafb661
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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