Water → HCID 20150399, compound

HRID 194863Notes

Reaction equation

HRID 194863 reaction equation
[CH2:1]1[CH2:2][NH:3][CH2:4][CH2:5][NH:6]1.[CH3:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[CH3:7][O:8][c:9]1[c:10]([CH3:36])[c:11]([CH3:35])[c:12]2[c:13]([c:33]1[CH3:34])[CH2:14][CH2:15][C:16]([CH3:18])([CH2:19][CH2:20][CH2:21][O:22][S:23]([c:24]1[cH:25][cH:26][c:27]([CH3:28])[cH:29][cH:30]1)(=[O:31])=[O:32])[O:17]2.[OH2:37]>>[CH2:1]1[CH2:2][N:3]([CH2:21][CH2:20][CH2:19][C:16]2([CH3:18])[CH2:15][CH2:14][c:13]3[c:12]([c:11]([CH3:35])[c:10]([CH3:36])[c:9]([O:8][CH3:7])[c:33]3[CH3:34])[O:17]2)[CH2:4][CH2:5][NH:6]1

Participants

5

Reactant 4

HCID 962WaterHCID 1140TolueneHCID 4837PiperazineHCID 20150417HCID 20150417, compound

Product 1

HCID 20150399HCID 20150399, compound

Sources & evidence

ORD record
ord-7e2b0e4e2daa4c679bced159718b7fab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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