Hydrochloric Acid → HCID 22710467, compound

HRID 2315937Notes

Reaction equation

HRID 2315937 reaction equation
[C:50]([O:51][CH:52]([CH3:53])[O:54][C:55]([CH3:56])=[O:57])([O:58][c:60]1[cH:61][cH:62][c:63]([N+:64]([O-:65])=[O:66])[cH:67][cH:68]1)=[O:59].[CH3:69][CH2:70][OH:71].[CH:41]([N:42]([CH:43]([CH3:44])[CH3:45])[CH2:46][CH3:47])([CH3:48])[CH3:49].[Cl:2][c:3]1[cH:4][c:5]2[cH:6][c:7]([S:12](=[O:13])(=[O:14])[N:15]3[CH2:16][CH:17]([CH2:32][C:33](=[O:34])[N:35]4[CH2:36][CH2:37][O:38][CH2:39][CH2:40]4)[N:18]([C:21](=[O:22])[c:23]4[s:24][c:25]5[c:30]([n:31]4)[CH2:29][CH2:28][NH:27][CH2:26]5)[CH2:19][CH2:20]3)[nH:8][c:9]2[cH:10][cH:11]1.[ClH:1]>>[Cl:2][c:3]1[cH:4][c:5]2[cH:6][c:7]([S:12](=[O:13])(=[O:14])[N:15]3[CH2:16][CH:17]([CH2:32][C:33](=[O:34])[N:35]4[CH2:36][CH2:37][O:38][CH2:39][CH2:40]4)[N:18]([C:21](=[O:22])[c:23]4[s:24][c:25]5[c:30]([n:31]4)[CH2:29][CH:28]([C:50]([O:51][CH:52]([CH3:53])[O:54][C:55]([CH3:56])=[O:57])=[O:58])[NH:27][CH2:26]5)[CH2:19][CH2:20]3)[nH:8][c:9]2[cH:10][cH:11]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 702EthanolHCID 81531DiisopropylethylamineHCID 117805601-acetoxyethyl p-nitrophenyl carbonateHCID 227099802-[4-[(5-chloro-1H-indol-2-yl)sulfonyl]-1-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine-2-carbonyl)piperazin-2-yl]-1-morpholin-4-ylethanone

Product 1

HCID 22710467HCID 22710467, compound

Sources & evidence

ORD record
ord-e1d19c94b31546d48a13fd9e83c1c7b6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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