Hydrochloric Acid → HCID 71138622, compound

HRID 2310224Notes

Reaction equation

HRID 2310224 reaction equation
[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[CH3:52][S:53]([Cl:54])(=[O:55])=[O:56].[CH3:60][CH2:61][O:62][C:63]([CH3:64])=[O:65].[Cl:57][CH2:58][Cl:59].[ClH:1].[ClH:2].[ClH:3].[ClH:4].[NH2:5][C:6]1([c:10]2[cH:11][cH:12][c:13](-[n:16]3[c:17](-[c:38]4[c:39]([NH2:44])[n:40][cH:41][cH:42][cH:43]4)[n:18][c:19]4[c:20]3[n:21][c:22](-[c:25]3[cH:26][c:27]([N:31]5[CH2:32][CH2:33][CH:34]([NH2:37])[CH2:35][CH2:36]5)[cH:28][cH:29][cH:30]3)[cH:23][cH:24]4)[cH:14][cH:15]2)[CH2:7][CH2:8][CH2:9]1>>[NH2:5][C:6]1([c:10]2[cH:11][cH:12][c:13](-[n:16]3[c:17](-[c:38]4[c:39]([NH2:44])[n:40][cH:41][cH:42][cH:43]4)[n:18][c:19]4[c:20]3[n:21][c:22](-[c:25]3[cH:26][c:27]([N:31]5[CH2:32][CH2:33][CH:34]([NH:37][S:53]([CH3:52])(=[O:55])=[O:56])[CH2:35][CH2:36]5)[cH:28][cH:29][cH:30]3)[cH:23][cH:24]4)[cH:14][cH:15]2)[CH2:7][CH2:8][CH2:9]1

Participants

7

Reactant 6

HCID 313Hydrochloric Acid4×HCID 6344DichloromethaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 31297Methanesulfonyl chlorideHCID 71138639HCID 71138639, compound

Product 1

HCID 71138622HCID 71138622, compound

Sources & evidence

ORD record
ord-7de18f2dd5d6451f9f5a9df6a4f7bee4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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