Ammonium → 3-(3-(1-(2-(benzyloxy)phenyl)cyclobutylamino)-5-bromo-2-oxopyrazin-1(2H)-yl)-N-cyclopropyl-4-methylbenzamide

HRID 665199Notes

Reaction equation

HRID 665199 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:15]2([NH:19][c:20]3[c:21](=[O:38])[n:22](-[c:27]4[cH:28][c:29]([C:30]([O:32][CH3:31])=[O:33])[cH:34][cH:35][c:36]4[CH3:37])[cH:23][c:24]([Br:26])[n:25]3)[CH2:16][CH2:17][CH2:18]2)[cH:11][cH:12][cH:13][cH:14]1.[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[CH:39]1([NH2:42])[CH2:40][CH2:41]1.[CH:44]([Mg+:45])([CH3:46])[CH3:47].[Cl-:43].[Cl-:53].[NH4+:54]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:15]2([NH:19][c:20]3[c:21](=[O:38])[n:22](-[c:27]4[cH:28][c:29]([C:30](=[O:32])[NH:42][CH:39]5[CH2:40][CH2:41]5)[cH:34][cH:35][c:36]4[CH3:37])[cH:23][c:24]([Br:26])[n:25]3)[CH2:16][CH2:17][CH2:18]2)[cH:11][cH:12][cH:13][cH:14]1

Participants

7

Reactant 6

HCID 223AmmoniumHCID 312Chloride2×HCID 8028TetrahydrofuranHCID 69828CyclopropylamineHCID 66689709Methyl 3-(3-(1-(2-(benzyloxy)phenyl)cyclobutylamino)-5-bromo-2-oxopyrazin-1(2H)-yl)-4-methylbenzoateHCID 178461726HCID 178461726, compound

Product 1

HCID 666896093-(3-(1-(2-(benzyloxy)phenyl)cyclobutylamino)-5-bromo-2-oxopyrazin-1(2H)-yl)-N-cyclopropyl-4-methylbenzamide

Sources & evidence

ORD record
ord-1bf107ecea5f4598a17beb1ec9c850cf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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