Water → tert-butyl 1-[(1-methoxy-3,3-dimethyl-1-oxobutan-2-yl)carbamoyl]-3-phenyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxylate

HRID 2344530Notes

Reaction equation

HRID 2344530 reaction equation
[B-:45]([F:46])([F:47])([F:48])[F:49].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][c:10]2[n:11]([c:14](-[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[n:15][c:16]2[C:17](=[O:18])[OH:19])[CH2:12][CH2:13]1.[CH:36]([N:37]([CH2:38][CH3:39])[CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[NH2:26][CH:27]([C:28](=[O:29])[O:30][CH3:31])[C:32]([CH3:33])([CH3:34])[CH3:35].[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[OH2:72].[n:50]1([O:51][C:52]([N:53]([CH3:54])[CH3:55])=[N+:56]([CH3:57])[CH3:58])[c:59]2[cH:60][cH:61][cH:62][cH:63][c:64]2[n:65][n:66]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][c:10]2[n:11]([c:14](-[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[n:15][c:16]2[C:17](=[O:19])[NH:26][CH:27]([C:28](=[O:29])[O:30][CH3:31])[C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:12][CH2:13]1

Participants

8

Reactant 7

HCID 962WaterHCID 6228DimethylformamideHCID 26255TetrafluoroborateHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 3831185Methyl DL-tert-leucinateHCID 576351557-(Tert-butoxycarbonyl)-3-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine-1-carboxylic acid

Product 1

HCID 66932050tert-butyl 1-[(1-methoxy-3,3-dimethyl-1-oxobutan-2-yl)carbamoyl]-3-phenyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxylate

Sources & evidence

ORD record
ord-c2a57bd53ccd466088b68caafbca0228
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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