Water → HCID 67809283, compound

HRID 189598Notes

Reaction equation

HRID 189598 reaction equation
[C:17]([CH3:18])([CH3:19])([CH3:20])[O:21][C:22](=[O:23])[N:24]1[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]1.[CH3:1][S:2][C:3](=[C:4]1[C:5](=[O:14])[C:6]2=[CH:7][CH:8]=[CH:9][CH2:10][CH:11]2[CH2:12][CH2:13]1)[S:15][CH3:16].[CH3:31][C:32]#[N:33].[OH2:30]>>[C:3](=[C:4]1[C:5](=[O:14])[C:6]2=[CH:7][CH:8]=[CH:9][CH2:10][CH:11]2[CH2:12][CH2:13]1)([S:15][CH3:16])[N:27]1[CH2:26][CH2:25][N:24]([C:22]([O:21][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:23])[CH2:29][CH2:28]1

Participants

5

Reactant 4

HCID 962WaterHCID 6342AcetonitrileHCID 143452tert-Butyl piperazine-1-carboxylateHCID 70254017HCID 70254017, compound

Product 1

HCID 67809283HCID 67809283, compound

Sources & evidence

ORD record
ord-45ad74436fd04dbca32aed64644a6632
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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