Hydroxide → HCID 72371135, compound

HRID 294058Notes

Reaction equation

HRID 294058 reaction equation
[CH3:61][CH2:62][O:63][C:64]([CH3:65])=[O:66].[Li+:59].[N+:1]([c:2]1[cH:3][cH:4][c:5]([S:6](=[O:7])(=[O:8])[N:13]([c:14]2[cH:15][n:16][cH:17][cH:18][cH:19]2)[CH:20]2[CH2:21][N:22]([CH2:25][c:26]3[cH:27][cH:28][c:29]([C:30](=[O:31])[NH:32][c:33]4[c:34]([NH:44][C:45]([O:46][C:47]([CH3:48])([CH3:49])[CH3:50])=[O:51])[cH:35][cH:36][c:37](-[c:39]5[s:40][cH:41][cH:42][cH:43]5)[cH:38]4)[cH:52][cH:53]3)[CH2:23][CH2:24]2)[cH:9][cH:10]1)([O-:11])=[O:12].[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[OH-:60].[SH:54][CH2:55][C:56]([OH:57])=[O:58]>>[NH:13]([c:14]1[cH:15][n:16][cH:17][cH:18][cH:19]1)[CH:20]1[CH2:21][N:22]([CH2:25][c:26]2[cH:27][cH:28][c:29]([C:30](=[O:31])[NH:32][c:33]3[c:34]([NH:44][C:45]([O:46][C:47]([CH3:48])([CH3:49])[CH3:50])=[O:51])[cH:35][cH:36][c:37](-[c:39]4[s:40][cH:41][cH:42][cH:43]4)[cH:38]3)[cH:52][cH:53]2)[CH2:23][CH2:24]1

Participants

7

Reactant 6

HCID 961HydroxideHCID 1133Thioglycolic AcidHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 28486Lithium ionHCID 178452682HCID 178452682, compound

Product 1

HCID 72371135HCID 72371135, compound

Sources & evidence

ORD record
ord-642fdb45001441d69f29424a6688f4ac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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