Hydrochloric Acid → HCID 136384410, compound

HRID 2125756Notes

Reaction equation

HRID 2125756 reaction equation
[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([n:9][cH:10][n:11][c:12]2[NH:13][c:14]2[c:15]([S:48][c:49]3[cH:50][cH:51][c:52]([NH:55][C:56](=[O:57])[O:58][C:59]([CH3:60])([CH3:61])[CH3:62])[cH:53][cH:54]3)[cH:16][cH:17][c:18]([C:20]([NH:21][c:22]3[cH:23][cH:24][c:25](-[c:28]4[n:29][c:30]([CH:33]5[N:34]([C:38]([CH2:39][c:40]6[cH:41][cH:42][cH:43][cH:44][cH:45]6)=[O:46])[CH2:35][CH2:36][CH2:37]5)[nH:31][cH:32]4)[cH:26][cH:27]3)=[O:47])[cH:19]2)[n:63]1.[ClH:64].[O:65]1[CH2:66][CH2:67][O:68][CH2:69][CH2:70]1.[O:71]1[CH2:72][CH2:73][CH2:74][CH2:75]1>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([n:9][cH:10][n:11][c:12]2[NH:13][c:14]2[c:15]([S:48][c:49]3[cH:50][cH:51][c:52]([NH2:55])[cH:53][cH:54]3)[cH:16][cH:17][c:18]([C:20]([NH:21][c:22]3[cH:23][cH:24][c:25](-[c:28]4[n:29][c:30]([CH:33]5[N:34]([C:38]([CH2:39][c:40]6[cH:41][cH:42][cH:43][cH:44][cH:45]6)=[O:46])[CH2:35][CH2:36][CH2:37]5)[nH:31][cH:32]4)[cH:26][cH:27]3)=[O:47])[cH:19]2)[n:63]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 8028TetrahydrofuranHCID 312751,4-DioxaneHCID 136403173HCID 136403173, compound

Product 1

HCID 136384410HCID 136384410, compound

Sources & evidence

ORD record
ord-2d8678f535a84ac1b8366ff1772d3cc9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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