Acetic Acid → HCID 66772732, compound

HRID 1571225Notes

Reaction equation

HRID 1571225 reaction equation
[CH2:30]1[CH2:31][CH2:32][NH:33][CH2:34]1.[CH3:35][C:36](=[O:37])[OH:38].[CH3:39][S:40](=[O:41])[CH3:42].[F:1][c:2]1[cH:3][c:4]([S:12](=[O:13])(=[O:14])[N:15]([CH:16]2[c:17]3[cH:18][n:19][n:20]([CH2:25][C:26](=[O:27])[OH:28])[c:21]3[CH2:22][CH2:23][CH2:24]2)[CH3:29])[cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1>>[c:2]1([N:33]2[CH2:32][CH2:31][CH2:30][CH2:34]2)[cH:3][c:4]([S:12](=[O:13])(=[O:14])[N:15]([CH:16]2[c:17]3[cH:18][n:19][n:20]([CH2:25][C:26](=[O:27])[OH:28])[c:21]3[CH2:22][CH2:23][CH2:24]2)[CH3:29])[cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 679Dimethyl SulfoxideHCID 31268PyrrolidineHCID 66772385HCID 66772385, compound

Product 1

HCID 66772732HCID 66772732, compound

Sources & evidence

ORD record
ord-ae850ff2c71e415587b089f2e56a7eba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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