Dichloromethane → ethyl 4-[(4-iodo-1H-pyrrole-2-carbonyl)amino]but-2-enoate

HRID 296873Notes

Reaction equation

HRID 296873 reaction equation
[CH:29]([N:30]([CH2:31][CH3:32])[CH:33]([CH3:34])[CH3:35])([CH3:36])[CH3:37].[Cl:17][C:18]([C:19](=[O:20])[c:21]1[nH:22][cH:23][c:24]([I:26])[cH:25]1)([Cl:27])[Cl:28].[Cl:38][CH2:39][Cl:40].[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[NH2:8][CH2:9][CH:10]=[CH:11][C:12](=[O:13])[O:14][CH2:15][CH3:16]>>[NH:8]([CH2:9][CH:10]=[CH:11][C:12](=[O:13])[O:14][CH2:15][CH3:16])[C:19](=[O:20])[c:21]1[nH:22][cH:23][c:24]([I:26])[cH:25]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 81531DiisopropylethylamineHCID 116816022,2,2-trichloro-1-(4-iodo-1H-pyrrol-2-yl)ethan-1-oneHCID 53413332Ethyl 4-amino-2-butenoate

Product 1

HCID 90845243ethyl 4-[(4-iodo-1H-pyrrole-2-carbonyl)amino]but-2-enoate

Sources & evidence

ORD record
ord-84cbed70c91549d4a43832110cea9404
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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