Hydrochloric Acid → HCID 178464952, compound

HRID 1559369Notes

Reaction equation

HRID 1559369 reaction equation
[C:8]([O:9][C:13](=[O:14])[NH:15][CH:16]([CH3:17])[C:18](=[O:19])[NH:20][CH:21]1[CH:22]([O:27][CH2:28][c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[O:23][C:24](=[O:26])[CH2:25]1)([CH3:10])([CH3:11])[CH3:12].[CH3:62][N:63]([CH3:64])[CH2:65][CH2:66][CH2:67][N:68]=[C:69]=[N:70][CH2:71][CH3:72].[CH:35]([N:36]([CH:37]([CH3:38])[CH3:39])[CH2:40][CH3:41])([CH3:42])[CH3:43].[Cl:83][CH2:84][Cl:85].[ClH:61].[O:86]=[CH:87][N:88]([CH3:89])[CH3:90].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7].[OH:73][c:74]1[c:75]2[n:76][n:77][nH:78][c:79]2[cH:80][cH:81][cH:82]1.[c:44]1([CH2:50][CH2:51][CH2:52][c:53]2[n:54][c:55]([C:58]([OH:59])=[O:60])[nH:56][cH:57]2)[cH:45][cH:46][cH:47][cH:48][cH:49]1>>[C:13](=[O:14])([NH:15][CH:16]([CH3:17])[C:18](=[O:19])[NH:20][CH:21]1[CH:22]([O:27][CH2:28][c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[O:23][C:24](=[O:26])[CH2:25]1)[c:55]1[n:54][c:53]([CH2:52][CH2:51][CH2:50][c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[cH:57][nH:56]1

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 81531DiisopropylethylamineHCID 19700366HCID 19700366, compoundHCID 178418300HCID 178418300, compoundHCID 178524887HCID 178524887, compound

Product 1

HCID 178464952HCID 178464952, compound

Sources & evidence

ORD record
ord-821b6bf3144c44c799789b45219d0022
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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