1,4-Dimercapto-2,3-butanediol → HCID 178522586, compound

HRID 301807Notes

Reaction equation

HRID 301807 reaction equation
[CH:1]1([N:7]([C:8](=[O:9])[NH:10][c:11]2[s:12][c:13]([S:16][C:17]#[N:18])[cH:14][n:15]2)[CH:19]2[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Cl:33][CH2:34][CH2:35][c:36]1[n:37][n:38][n:39][nH:40]1.[SH:25][CH2:26][CH:27]([CH:28]([CH2:29][SH:30])[OH:31])[OH:32]>>[CH:1]1([N:7]([C:8](=[O:9])[NH:10][c:11]2[s:12][c:13]([S:16][CH2:34][CH2:35][c:36]3[n:37][n:38][n:39][nH:40]3)[cH:14][n:15]2)[CH:19]2[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

4

Reactant 3

HCID 190011,4-Dimercapto-2,3-butanediolHCID 866111921,1-Dicyclohexyl-3-(5-thiocyanato-thiazol-2-yl)-ureaHCID 178478456HCID 178478456, compound

Product 1

HCID 178522586HCID 178522586, compound

Sources & evidence

ORD record
ord-8442ac42b0474287b77f15fabdda3c64
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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