Ammonia → HCID 178427056, compound

HRID 1565747Notes

Reaction equation

HRID 1565747 reaction equation
[B-:18]([F:19])([F:20])([F:21])[F:22].[CH2:64]([OH:65])[CH3:66].[CH3:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[OH:7])[cH:8][cH:9][c:10]1[C:11](=[O:12])[N:13]1[CH2:14][CH2:15][CH2:16][CH2:17]1.[CH3:71][N:72]([CH3:73])[CH:74]=[O:75].[CH:40]([N:41]([CH:42]([CH3:43])[CH3:44])[CH2:45][CH3:46])([CH3:47])[CH3:48].[Cl:67][CH2:68][Cl:69].[Cl:70].[NH2:49][c:50]1[cH:51][c:52]([Cl:62])[cH:53][c:54]2[c:55]1[nH:56][c:57]([CH:59]([CH3:60])[NH2:61])[n:58]2.[NH3:63].[n:23]1([O:24][C:25]([N:26]([CH3:27])[CH3:28])=[N+:29]([CH3:30])[CH3:31])[c:32]2[cH:33][cH:34][cH:35][cH:36][c:37]2[n:38][n:39]1>>[CH3:1][c:2]1[cH:3][c:4]([C:5](=[O:7])[NH:61][CH:59]([c:57]2[nH:56][c:55]3[c:50]([NH2:49])[cH:51][c:52]([Cl:62])[cH:53][c:54]3[n:58]2)[CH3:60])[cH:8][cH:9][c:10]1[C:11](=[O:12])[N:13]1[CH2:14][CH2:15][CH2:16][CH2:17]1

Participants

11

Reactant 10

HCID 222AmmoniaHCID 313Hydrochloric AcidHCID 702EthanolHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 26255TetrafluoroborateHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 120686863-Methyl 4-(pyrrolidin-1-ylcarbonyl)benzoic acidHCID 178463385HCID 178463385, compound

Product 1

HCID 178427056HCID 178427056, compound

Sources & evidence

ORD record
ord-919d5e0fd08a4e18bc11e1100ce044f6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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