Hydrochloric Acid → HCID 74928716, compound

HRID 1217336Notes

Reaction equation

HRID 1217336 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:9]([cH:10]1)[NH:8][C:7](=[O:11])[C:6]21[CH:12]([c:34]2[c:35]([CH3:41])[cH:36][cH:37][c:38]([F:40])[cH:39]2)[NH:13][C:14](=[O:33])[CH2:15][CH:16]1[c:17]1[c:18]([O:24][C:25]([CH2:26][CH3:27])([C:28](=[O:29])[OH:30])[CH2:31][CH3:32])[cH:19][cH:20][c:21]([Cl:23])[cH:22]1.[C:42]([n:43]1[cH:44][cH:45][n:46][cH:47]1)([n:48]1[cH:49][cH:50][n:51][cH:52]1)=[O:53].[CH3:54][S:55](=[O:56])(=[O:57])[NH2:58].[ClH:61].[H-:60].[Na+:59].[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[OH2:67]>>[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:9]([cH:10]1)[NH:8][C:7](=[O:11])[C:6]21[CH:12]([c:34]2[c:35]([CH3:41])[cH:36][cH:37][c:38]([F:40])[cH:39]2)[NH:13][C:14](=[O:33])[CH2:15][CH:16]1[c:17]1[c:18]([O:24][C:25]([CH2:26][CH3:27])([C:28](=[O:29])[NH:58][S:55]([CH3:54])(=[O:56])=[O:57])[CH2:31][CH3:32])[cH:19][cH:20][c:21]([Cl:23])[cH:22]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 682631,1'-CarbonyldiimidazoleHCID 72879MethanesulfonamideHCID 166653HydrideHCID 72296192HCID 72296192, compound

Product 1

HCID 74928716HCID 74928716, compound

Sources & evidence

ORD record
ord-d875fbb9094b49e880640dcd82ae8eaf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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