Acetonitrile → HCID 59240607, compound

HRID 99052Notes

Reaction equation

HRID 99052 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[n:9][n:10][c:11]([N:18]2[CH2:19][CH2:20][N:21]([c:24]3[n:25][cH:26][c:27]([C:30]([CH2:31][O:32][S:33]([CH3:34])(=[O:35])=[O:36])([CH3:37])[OH:38])[n:28][cH:29]3)[CH2:22][CH2:23]2)[c:12]2[cH:13][cH:14][cH:15][cH:16][c:17]12.[CH3:46][C:47]#[N:48].[OH:39][CH:40]1[CH2:41][CH2:42][NH:43][CH2:44][CH2:45]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[n:9][n:10][c:11]([N:18]2[CH2:19][CH2:20][N:21]([c:24]3[n:25][cH:26][c:27]([C:30]([CH2:31][N:43]4[CH2:42][CH2:41][CH:40]([OH:39])[CH2:45][CH2:44]4)([CH3:37])[OH:38])[n:28][cH:29]3)[CH2:22][CH2:23]2)[c:12]2[cH:13][cH:14][cH:15][cH:16][c:17]12

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 79341Piperidin-4-olHCID 59240656HCID 59240656, compound

Product 1

HCID 59240607HCID 59240607, compound

Sources & evidence

ORD record
ord-d10fcc8f3e664e42bd8270f722a0a83a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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