1,4-Dimercapto-2,3-butanediol → HCID 57883832, compound

HRID 1129226Notes

Reaction equation

HRID 1129226 reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][CH:7]([N:10]([C:11](=[O:12])[NH:13][c:14]2[s:15][c:16]([S:19][C:20]#[N:21])[cH:17][n:18]2)[CH:22]2[CH2:23][CH2:24][CH:25]([CH3:28])[CH2:26][CH2:27]2)[CH2:8][CH2:9]1.[Cl:37][CH2:38][CH2:39][N:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[SH:29][CH2:30][CH:31]([CH:32]([CH2:33][SH:34])[OH:35])[OH:36]>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][CH:7]([N:10]([C:11](=[O:12])[NH:13][c:14]2[s:15][c:16]([S:19][CH2:20][CH2:39][N:40]3[CH2:41][CH2:42][CH2:43][CH2:44]3)[cH:17][n:18]2)[CH:22]2[CH2:23][CH2:24][CH:25]([CH3:28])[CH2:26][CH2:27]2)[CH2:8][CH2:9]1

Participants

4

Reactant 3

HCID 190011,4-Dimercapto-2,3-butanediolHCID 816691-(2-Chloroethyl)pyrrolidineHCID 86611196HCID 86611196, compound

Product 1

HCID 57883832HCID 57883832, compound

Sources & evidence

ORD record
ord-d7802697722747229ffa2f37319caf74
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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