Acetate → HCID 21300417, compound

HRID 204266Notes

Reaction equation

HRID 204266 reaction equation
[C:44]([O-:45])(=[O:46])[CH3:47].[C:49]([O-:50])(=[O:51])[CH3:52].[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][C:12](=[O:13])[O:14][CH2:15][CH2:16][c:17]2[cH:18][cH:19][c:20]([B:23]([OH:24])[OH:25])[cH:21][cH:22]2)[cH:6][cH:7]1.[CH3:26][c:27]1[cH:28][c:29]2[n:30][cH:31][nH:32][c:33]2[cH:34][c:35]1[CH3:36].[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[Cl:53][CH2:54][Cl:55].[Cu+2:48]>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][C:12](=[O:13])[O:14][CH2:15][CH2:16][c:17]2[cH:18][cH:19][c:20](-[n:30]3[c:29]4[cH:28][c:27]([CH3:26])[c:35]([CH3:36])[cH:34][c:33]4[n:32][cH:31]3)[cH:21][cH:22]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 175Acetate2×HCID 6755,6-DimethylbenzimidazoleHCID 6344DichloromethaneHCID 8471TriethylamineHCID 27099Cupric cationHCID 218765304-{2-[({[(4-Methylphenyl)sulfonyl]amino]carbonyl)oxy]ethyl}phenylboronic acid

Product 1

HCID 21300417HCID 21300417, compound

Sources & evidence

ORD record
ord-fe92c66c876d4d31aad251360024e2ca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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