Hydrochloric Acid → tert-butyl 2-methoxy-2-methyl-1-((4-(5-methyl-3-oxo-1H-imidazo[1,5-c]imidazol-2(3H)-yl)-1-piperidinyl)carbonyl)propylcarbamate

HRID 1574161Notes

Reaction equation

HRID 1574161 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:11])[OH:12])[C:13]([CH3:14])([CH3:15])[O:16][CH3:17].[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[CH3:37][c:38]1[n:39][cH:40][c:41]2[n:42]1[C:43](=[O:52])[N:44]([CH:46]1[CH2:47][CH2:48][NH:49][CH2:50][CH2:51]1)[CH2:45]2.[CH3:53][C:54]#[N:55].[ClH:35].[ClH:36].[OH:18][n:19]1[c:20]2[c:21]([cH:22][cH:23][cH:24][cH:25]2)[n:26][n:27]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:12])[N:49]1[CH2:48][CH2:47][CH:46]([N:44]2[C:43](=[O:52])[n:42]3[c:38]([CH3:37])[n:39][cH:40][c:41]3[CH2:45]2)[CH2:51][CH2:50]1)[C:13]([CH3:14])([CH3:15])[O:16][CH3:17]

Participants

7

Reactant 6

HCID 313Hydrochloric Acid2×HCID 6342AcetonitrileHCID 8471TriethylamineHCID 757711-HydroxybenzotriazoleHCID 230840155-methyl-2-(4-piperidinyl)-1,2-dihydro-3H-imidazo[1,5-c]imidazol-3-oneHCID 231384102-(((Tert-butoxy)carbonyl)amino)-3-methoxy-3-methylbutanoic acid

Product 1

HCID 23138125tert-butyl 2-methoxy-2-methyl-1-((4-(5-methyl-3-oxo-1H-imidazo[1,5-c]imidazol-2(3H)-yl)-1-piperidinyl)carbonyl)propylcarbamate

Sources & evidence

ORD record
ord-f95535f995c7498c880a04e9ebac1450
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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