Methanol → HCID 178453418, compound

HRID 1537337Notes

Reaction equation

HRID 1537337 reaction equation
[C:44]([CH3:45])([CH3:46])([CH3:47])[O:48][C:49]([NH:50][CH:51]([CH2:52][CH2:53][CH2:54][CH2:55][NH:56][C:57](=[O:58])[O:59][CH2:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1)[CH2:67][NH2:68])=[O:69].[CH3:37][N:38]1[CH2:39][CH2:40][O:41][CH2:42][CH2:43]1.[CH3:75][OH:76].[NH2:1][c:2]1[c:3]([C:10](=[O:11])[OH:12])[n:4][c:5]([Cl:9])[c:6]([NH2:8])[n:7]1.[O:70]=[CH:71][N:72]([CH3:73])[CH3:74].[P-:13]([F:14])([F:15])([F:16])([F:17])([F:18])[F:19].[n:20]1([O:21][C:22]([N:23]([CH3:24])[CH3:25])=[N+:26]([CH3:27])[CH3:28])[c:29]2[n:30][cH:31][cH:32][cH:33][c:34]2[n:35][n:36]1>>[NH2:1][c:2]1[c:3]([C:10](=[O:12])[NH:68][CH2:67][CH:51]([NH:50][C:49]([O:48][C:44]([CH3:45])([CH3:46])[CH3:47])=[O:69])[CH2:52][CH2:53][CH2:54][CH2:55][NH:56][C:57](=[O:58])[O:59][CH2:60][c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[n:4][c:5]([Cl:9])[c:6]([NH2:8])[n:7]1

Participants

8

Reactant 7

HCID 887MethanolHCID 6228DimethylformamideHCID 79724-MethylmorpholineHCID 9886HexafluorophosphateHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 64521193,5-Diamino-6-chloro-pyrazine acidHCID 77216447HCID 77216447, compound

Product 1

HCID 178453418HCID 178453418, compound

Sources & evidence

ORD record
ord-ea8f3fc40fe54e8681866cc2779ae554
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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