Hydrochloric Acid → HCID 178492302, compound

HRID 319751Notes

Reaction equation

HRID 319751 reaction equation
[CH3:12][O:13][c:14]1[cH:15][c:16]([NH2:21])[c:17]([NH2:20])[cH:18][cH:19]1.[CH3:60][CH2:61][O:62][C:63]([CH3:64])=[O:65].[CH:46]([N:47]([CH:48]([CH3:49])[CH3:50])[CH2:51][CH3:52])([CH3:53])[CH3:54].[ClH:10].[ClH:11].[I:1][c:2]1[c:3]([C:7](=[O:8])[OH:9])[n:4][nH:5][cH:6]1.[O:55]=[CH:56][N:57]([CH3:58])[CH3:59].[P-:22]([F:23])([F:24])([F:25])([F:26])([F:27])[F:28].[n:29]1([O:30][C:31]([N:32]([CH3:33])[CH3:34])=[N+:35]([CH3:36])[CH3:37])[c:38]2[n:39][cH:40][cH:41][cH:42][c:43]2[n:44][n:45]1>>[I:1][c:2]1[c:3]([C:7](=[O:9])[NH:21][c:16]2[cH:15][c:14]([O:13][CH3:12])[cH:19][cH:18][c:17]2[NH2:20])[n:4][nH:5][cH:6]1

Participants

9

Reactant 8

HCID 313Hydrochloric Acid2×HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 1534044-Methoxy-o-phenylenediamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 178524950HCID 178524950, compound

Product 1

HCID 178492302HCID 178492302, compound

Sources & evidence

ORD record
ord-6f79f5c26b42462b8604e0d039b56f2c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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