Acetic Acid → HCID 59199262, compound

HRID 677747Notes

Reaction equation

HRID 677747 reaction equation
[CH3:41][C:42](=[O:43])[OH:44].[CH:36]([CH:37]([CH3:38])[CH3:39])=[O:40].[Cl:45][CH2:46][Cl:47].[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[NH:8]1[CH2:9][CH2:10][CH:11]([O:14][c:15]2[cH:16][cH:17][cH:18][c:19]3[cH:20][n:21][c:22]([NH:25][c:26]4[cH:27][cH:28][c:29]([S:32](=[O:33])(=[O:34])[NH2:35])[cH:30][cH:31]4)[n:23][c:24]23)[CH2:12][CH2:13]1>>[N:8]1([CH2:36][CH:37]([CH3:38])[CH3:39])[CH2:9][CH2:10][CH:11]([O:14][c:15]2[cH:16][cH:17][cH:18][c:19]3[cH:20][n:21][c:22]([NH:25][c:26]4[cH:27][cH:28][c:29]([S:32](=[O:33])(=[O:34])[NH2:35])[cH:30][cH:31]4)[n:23][c:24]23)[CH2:12][CH2:13]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 6561IsobutyraldehydeHCID 59199316HCID 59199316, compound

Product 1

HCID 59199262HCID 59199262, compound

Sources & evidence

ORD record
ord-943d6aafd8c14bb7841d975a9534c2e0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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