Water → HCID 68556599, compound

HRID 2345413Notes

Reaction equation

HRID 2345413 reaction equation
[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[Cl:1][c:2]1[n:3][n:4][c:5](-[c:8]2[n:9][c:10]([CH3:13])[n:11][o:12]2)[cH:6][cH:7]1.[NH:14]1[CH2:15][CH2:16][C:17]2([O:18][C:19](=[O:27])[NH:20][c:21]3[c:22]2[cH:23][cH:24][cH:25][cH:26]3)[CH2:28][CH2:29]1.[OH2:37]>>[c:2]1([N:14]2[CH2:15][CH2:16][C:17]3([O:18][C:19](=[O:27])[NH:20][c:21]4[c:22]3[cH:23][cH:24][cH:25][cH:26]4)[CH2:28][CH2:29]2)[n:3][n:4][c:5](-[c:8]2[n:9][c:10]([CH3:13])[n:11][o:12]2)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 13050639Spiro[3,1-benzoxazine-4,4'-piperidin]-2(1H)-oneHCID 167322943-Chloro-6-(3-methyl-1,2,4-oxadiazol-5-yl)pyridazine

Product 1

HCID 68556599HCID 68556599, compound

Sources & evidence

ORD record
ord-44ccc847cafb42ce92810ece9acf86e6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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