Hydrochloric Acid → HCID 178460204, compound

HRID 1548096Notes

Reaction equation

HRID 1548096 reaction equation
[CH3:56][C:57]([N:58]([CH3:59])[CH3:60])=[O:61].[ClH:36].[NH2:1][c:2]1[s:3][cH:4][c:5]([C:7]([C:8](=[O:9])[NH:10][CH:11]2[CH:12]3[S:13][CH2:14][C:15]([CH2:23][S:24](=[O:25])(=[O:26])[c:27]4[cH:28][c:29]([OH:34])[c:30]([OH:33])[cH:31][cH:32]4)=[C:16]([C:20](=[O:21])[OH:22])[N:17]3[C:18]2=[O:19])=[O:35])[n:6]1.[NH2:37][O:38][C:39]([C:40](=[O:41])[NH:42][NH:43][C:44]([c:45]1[cH:46][c:47]([OH:52])[c:48]([OH:51])[cH:49][cH:50]1)=[O:53])([CH3:54])[CH3:55]>>[NH2:1][c:2]1[s:3][cH:4][c:5]([C:7]([C:8](=[O:9])[NH:10][CH:11]2[CH:12]3[S:13][CH2:14][C:15]([CH2:23][S:24](=[O:25])(=[O:26])[c:27]4[cH:28][c:29]([OH:34])[c:30]([OH:33])[cH:31][cH:32]4)=[C:16]([C:20](=[O:21])[OH:22])[N:17]3[C:18]2=[O:19])=[N:37][O:38][C:39]([C:40](=[O:41])[NH:42][NH:43][C:44]([c:45]2[cH:46][c:47]([OH:52])[c:48]([OH:51])[cH:49][cH:50]2)=[O:53])([CH3:54])[CH3:55])[n:6]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 31374DimethylacetamideHCID 14852625HCID 14852625, compoundHCID 178508539HCID 178508539, compound

Product 1

HCID 178460204HCID 178460204, compound

Sources & evidence

ORD record
ord-4ffdfd446d7a4d58b4b3a2bbbee6ab5d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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