Hydrochloric Acid → HCID 178469323, compound

HRID 2320890Notes

Reaction equation

HRID 2320890 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7][n:8](-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:9]([O:11][CH2:12][C:13](=[O:14])[N:15]2[CH:16]([C:20](=[O:21])[OH:22])[CH2:17][CH2:18][CH2:19]2)[cH:10]1.[CH:53]([N:54]([CH2:55][CH3:56])[CH:57]([CH3:58])[CH3:59])([CH3:60])[CH3:61].[Cl:72][CH2:73][Cl:74].[ClH:62].[F:63][CH2:64][CH2:65][NH2:66].[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[P-:29]([F:30])([F:31])([F:32])([F:33])([F:34])[F:35].[n:36]1([O:37][C:38]([N:39]([CH3:40])[CH3:41])=[N+:42]([CH3:43])[CH3:44])[c:45]2[n:46][cH:47][cH:48][cH:49][c:50]2[n:51][n:52]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7][n:8](-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:9]([O:11][CH2:12][C:13](=[O:14])[N:15]2[CH:16]([C:20](=[O:22])[NH:66][CH2:65][CH2:64][F:63])[CH2:17][CH2:18][CH2:19]2)[cH:10]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 99962-FluoroethylamineHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 668544081-[2-(3-Ethoxycarbonyl-1-phenylpyrazol-5-yl)oxyacetyl]pyrrolidine-2-carboxylic acid

Product 1

HCID 178469323HCID 178469323, compound

Sources & evidence

ORD record
ord-feeef7596f3149ad9fcfb5ee949b21ea
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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