Hydrochloric Acid → HCID 178460096, compound

HRID 1131715Notes

Reaction equation

HRID 1131715 reaction equation
[Br:15][c:16]1[c:17]([NH:23][CH:24]([CH2:25][OH:26])[CH3:27])[n:18][c:19]([Cl:22])[n:20][cH:21]1.[CH3:34][C:35]#[N:36].[ClH:28].[NH2:1][c:2]1[cH:3][c:4]([S:8](=[O:9])(=[N:10][N+:11](=[O:12])[O-:13])[CH3:14])[cH:5][cH:6][cH:7]1.[Na+:33].[O-:29][C:30]([OH:31])=[O:32].[O:37]1[CH2:38][CH2:39][O:40][CH2:41][CH2:42]1>>[NH:1]([c:2]1[cH:3][c:4]([S:8](=[O:9])(=[N:10][N+:11](=[O:12])[O-:13])[CH3:14])[cH:5][cH:6][cH:7]1)[c:19]1[n:18][c:17]([NH:23][CH:24]([CH2:25][OH:26])[CH3:27])[c:16]([Br:15])[cH:21][n:20]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 6342AcetonitrileHCID 312751,4-DioxaneHCID 59674008HCID 59674008, compoundHCID 72454776HCID 72454776, compound

Product 1

HCID 178460096HCID 178460096, compound

Sources & evidence

ORD record
ord-57176011035743deb0082035d366a477
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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