Hydrochloric Acid → HCID 19604145, compound

HRID 2133810Notes

Reaction equation

HRID 2133810 reaction equation
[CH2:79]([Cl:80])[Cl:81].[CH3:49][O:50][C:51]([CH:52]([NH2:53])[CH2:54][c:55]1[cH:56][cH:57][c:58](-[c:61]2[s:62][cH:63][cH:64][n:65]2)[cH:59][cH:60]1)=[O:66].[CH3:67][CH2:68][N:69]([CH2:70][CH3:71])[CH2:72][CH3:73].[CH:11]1([N:12]=[C:13]=[N:14][CH:15]2[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20]2)[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25]1.[ClH:47].[ClH:48].[O:74]1[CH2:75][CH2:76][CH2:77][CH2:78]1.[OH:1][c:2]1[c:3]2[n:4][n:5][nH:6][c:7]2[cH:8][cH:9][cH:10]1.[c:26]1([C:32](=[O:33])[S:34][CH2:35][CH:36]([C:37](=[O:38])[OH:39])[CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[c:26]1([C:32](=[O:33])[S:34][CH2:35][CH:36]([C:37](=[O:39])[NH:53][CH:52]([C:51]([O:50][CH3:49])=[O:66])[CH2:54][c:55]2[cH:56][cH:57][c:58](-[c:61]3[s:62][cH:63][cH:64][n:65]3)[cH:59][cH:60]2)[CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[cH:27][cH:28][cH:29][cH:30][cH:31]1

Participants

9

Reactant 8

HCID 313Hydrochloric Acid2×HCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 10868DicyclohexylcarbodiimideHCID 11066528HCID 11066528, compoundHCID 18429016HCID 18429016, compoundHCID 178418300HCID 178418300, compound

Product 1

HCID 19604145HCID 19604145, compound

Sources & evidence

ORD record
ord-6a89e437cddf41d0a696103d3d21f54f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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