Dichloromethane → HCID 69659652, compound

HRID 1143998Notes

Reaction equation

HRID 1143998 reaction equation
[CH3:73][CH2:74][N:75]([CH2:76][CH3:77])[CH2:78][CH3:79].[Cl:80][CH2:81][Cl:82].[NH2:49][CH:50]([C:51]([CH2:52][O:53][C:54]([c:55]1[c:56]([CH3:62])[cH:57][cH:58][cH:59][c:60]1[CH3:61])=[O:63])=[O:64])[CH2:65][C:66](=[O:67])[O:68][C:69]([CH3:70])([CH3:71])[CH3:72].[OH:39][n:40]1[c:41]2[c:42]([cH:43][cH:44][cH:45][cH:46]2)[n:47][n:48]1.[c:1]1([S:7](=[O:8])(=[O:9])[N:10]2[CH2:11][CH:12]([C:36](=[O:37])[OH:38])[N:13]3[CH:14]([CH2:15][CH2:16][CH2:17][CH2:18][CH:19]([NH:22][C:23](=[O:24])[c:25]4[n:26][cH:27][cH:28][c:29]5[cH:30][cH:31][cH:32][cH:33][c:34]45)[C:20]3=[O:21])[CH2:35]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[N:10]2[CH2:11][CH:12]([C:36](=[O:37])[NH:49][CH:50]([C:51]([CH2:52][O:53][C:54]([c:55]3[c:56]([CH3:62])[cH:57][cH:58][cH:59][c:60]3[CH3:61])=[O:63])=[O:64])[CH2:65][C:66](=[O:67])[O:68][C:69]([CH3:70])([CH3:71])[CH3:72])[N:13]3[CH:14]([CH2:15][CH2:16][CH2:17][CH2:18][CH:19]([NH:22][C:23](=[O:24])[c:25]4[n:26][cH:27][cH:28][c:29]5[cH:30][cH:31][cH:32][cH:33][c:34]45)[C:20]3=[O:21])[CH2:35]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 757711-HydroxybenzotriazoleHCID 21882356HCID 21882356, compoundHCID 235714112,6-Dimethyl-benzoic acid 3-amino-4-tert-butoxycarbonyl-2-oxo-butyl ester

Product 1

HCID 69659652HCID 69659652, compound

Sources & evidence

ORD record
ord-c7f90a88cafb4681ab81ef65e87ea5e9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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