Water → HCID 68355384, compound

HRID 2150926Notes

Reaction equation

HRID 2150926 reaction equation
[CH2:33]1[O:34][CH2:35][CH2:36][CH2:37]1.[CH3:31][NH2:32].[CH3:38][N:39]1[CH2:40][CH2:41][CH2:42][C:43]1=[O:44].[CH:1]([CH3:2])([CH3:3])[n:4]1[n:5][cH:6][n:7][c:8]1-[c:9]1[cH:10][n:11]2[c:17]([n:18]1)-[c:16]1[c:15]([cH:22][c:21]([O:23][S:24]([C:25]([F:26])([F:27])[F:28])(=[O:29])=[O:30])[n:20][cH:19]1)[O:14][CH2:13][CH2:12]2.[OH2:45]>>[CH:1]([CH3:2])([CH3:3])[n:4]1[n:5][cH:6][n:7][c:8]1-[c:9]1[cH:10][n:11]2[c:17]([n:18]1)-[c:16]1[c:15]([cH:22][c:21]([NH:32][CH3:31])[n:20][cH:19]1)[O:14][CH2:13][CH2:12]2

Participants

6

Reactant 5

HCID 962WaterHCID 6329MethylamineHCID 8028TetrahydrofuranHCID 13387N-methyl-2-pyrrolidoneHCID 582049872-(1-isopropyl-1H-1,2,4-triazol-5-yl)-5,6-dihydroimidazo[1,2-d]pyrido[3,4-f][1,4]oxazepin-9-yl trifluoromethanesulfonate

Product 1

HCID 68355384HCID 68355384, compound

Sources & evidence

ORD record
ord-e93b0d1583b54ee4a049fa66f1bc9ce3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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