Water → HCID 59244687, compound

HRID 2322562Notes

Reaction equation

HRID 2322562 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][c:6]1[cH:7][c:8](-[c:12]2[c:13]3[c:14]([n:15][c:16]([N:18]4[CH2:19][CH2:20][O:21][CH2:22][CH2:23]4)[n:17]2)[NH:24][CH2:25][CH2:26]3)[cH:9][cH:10][cH:11]1.[C:42]([c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1)(=[O:49])[Cl:50].[CH3:33][N:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][n:40]1)[CH3:41].[CH3:52][C:53]#[N:54].[OH2:51].[cH:27]1[cH:28][cH:29][n:30][cH:31][cH:32]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][c:6]1[cH:7][c:8](-[c:12]2[c:13]3[c:14]([n:15][c:16]([N:18]4[CH2:19][CH2:20][O:21][CH2:22][CH2:23]4)[n:17]2)[N:24]([C:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)=[O:49])[CH2:25][CH2:26]3)[cH:9][cH:10][cH:11]1

Participants

7

Reactant 6

HCID 962WaterHCID 1049PyridineHCID 6342AcetonitrileHCID 7412Benzoyl chlorideHCID 218852-DimethylaminopyridineHCID 59244325HCID 59244325, compound

Product 1

HCID 59244687HCID 59244687, compound

Sources & evidence

ORD record
ord-3c18861fccf0406a93353dd86eca9392
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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