Ethanol → HCID 21935476, compound

HRID 1553422Notes

Reaction equation

HRID 1553422 reaction equation
[CH3:22][c:23]1[s:24][c:25]2[c:26]([n:27]1)[cH:28][c:29]([O:32][CH2:33][CH:34]([CH2:35][N:36]1[CH2:37][CH2:38][NH:39][CH2:40][CH2:41]1)[OH:42])[cH:30][cH:31]2.[CH3:43][CH2:44][OH:45].[CH:13]([N:14]([CH2:15][CH3:16])[CH:17]([CH3:18])[CH3:19])([CH3:20])[CH3:21].[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][O:6][c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1>>[CH2:2]([CH2:3][CH2:4][CH2:5][O:6][c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1)[N:39]1[CH2:38][CH2:37][N:36]([CH2:35][CH:34]([CH2:33][O:32][c:29]2[cH:28][c:26]3[c:25]([s:24][c:23]([CH3:22])[n:27]3)[cH:31][cH:30]2)[OH:42])[CH2:41][CH2:40]1

Participants

5

Reactant 4

HCID 702EthanolHCID 758574-Chlorobutyl phenyl etherHCID 81531DiisopropylethylamineHCID 219116911-(2-Methylbenzothiazol-5-yloxy)-3-piperazin-1-ylpropan-2-ol

Product 1

HCID 21935476HCID 21935476, compound

Sources & evidence

ORD record
ord-164139bc314a4212b4767c075ae1084d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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