Acetic Acid → HCID 178491359, compound

HRID 2135323Notes

Reaction equation

HRID 2135323 reaction equation
[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:27][C:28]([Cl:29])=[O:30].[CH3:2][O:3][c:4]1[c:5]([CH2:6][NH:7][C:8](=[NH:9])[NH:10][c:11]2[s:12][cH:13][c:14]([CH:16]3[NH:17][CH2:18][CH2:19][CH2:20]3)[n:15]2)[c:21]([O:25][CH3:26])[cH:22][cH:23][cH:24]1.[CH3:37][C:38](=[O:39])[OH:40].[ClH:1].[cH:31]1[cH:32][cH:33][n:34][cH:35][cH:36]1>>[CH3:2][O:3][c:4]1[c:5]([CH2:6][NH:7][C:8](=[NH:9])[NH:10][c:11]2[s:12][cH:13][c:14]([CH:16]3[N:17]([C:28]([CH3:27])=[O:30])[CH2:18][CH2:19][CH2:20]3)[n:15]2)[c:21]([O:25][CH3:26])[cH:22][cH:23][cH:24]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 1049PyridineHCID 6367Acetyl chlorideHCID 8028TetrahydrofuranHCID 178491362HCID 178491362, compound

Product 1

HCID 178491359HCID 178491359, compound

Sources & evidence

ORD record
ord-5b7bb438dd1440d881024753d24a2094
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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