Acetic Acid → HCID 178478146, compound

HRID 1238525Notes

Reaction equation

HRID 1238525 reaction equation
[CH3:19][C:20](=[O:21])[OH:22].[CH3:36][OH:37].[NH2:1][c:2]1[n:3][nH:4][c:5]2[n:6][cH:7][n:8][c:9]([NH:11][c:12]3[cH:13][c:14]([Cl:18])[cH:15][cH:16][cH:17]3)[c:10]12.[s:23]1[cH:24][n:25][cH:26][c:27]1-[c:28]1[cH:29][cH:30][c:31]([CH:32]=[O:33])[cH:34][cH:35]1>>[N:1]([c:2]1[n:3][nH:4][c:5]2[n:6][cH:7][n:8][c:9]([NH:11][c:12]3[cH:13][c:14]([Cl:18])[cH:15][cH:16][cH:17]3)[c:10]12)=[CH:32][c:31]1[cH:30][cH:29][c:28](-[c:27]2[s:23][cH:24][n:25][cH:26]2)[cH:35][cH:34]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 887MethanolHCID 10774002HCID 10774002, compoundHCID 178509242HCID 178509242, compound

Product 1

HCID 178478146HCID 178478146, compound

Sources & evidence

ORD record
ord-8a694549967d44c8a562a662816e45dd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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