Water → HCID 67184314, compound

HRID 174300Notes

Reaction equation

HRID 174300 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][n:8]2[n:9][c:10](-[c:23]3[cH:24][c:25]([N+:29](=[O:30])[O-:31])[cH:26][cH:27][cH:28]3)[c:11](-[c:13]3[n:14][c:15]([S:19]([CH3:20])(=[O:21])=[O:22])[n:16][cH:17][cH:18]3)[cH:12]2)[cH:32][cH:33]1.[CH3:34][CH2:35][NH2:36].[O:37]1[CH2:38][CH2:39][O:40][CH2:41][CH2:42]1.[OH2:43]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][n:8]2[n:9][c:10](-[c:23]3[cH:24][c:25]([N+:29](=[O:30])[O-:31])[cH:26][cH:27][cH:28]3)[c:11](-[c:13]3[n:14][c:15]([NH:36][CH2:35][CH3:34])[n:16][cH:17][cH:18]3)[cH:12]2)[cH:32][cH:33]1

Participants

5

Reactant 4

HCID 962WaterHCID 6341EthylamineHCID 312751,4-DioxaneHCID 67184047HCID 67184047, compound

Product 1

HCID 67184314HCID 67184314, compound

Sources & evidence

ORD record
ord-a2a641a809d040e5b78957494a1768d1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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