Hydrochloric Acid → HCID 69210669, compound

HRID 683334Notes

Reaction equation

HRID 683334 reaction equation
[CH3:19][O:20][CH2:21][CH2:22][CH:23]1[NH:24][CH2:25][CH2:26][NH:27][CH2:28]1.[CH3:38][S:39]([CH3:40])=[O:41].[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[CH3:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1.[CH:29]([N:30]([CH2:31][CH3:32])[CH:33]([CH3:34])[CH3:35])([CH3:36])[CH3:37].[Cl:2][c:3]1[cH:4][c:5]2[c:6]([cH:17][cH:18]1)[NH:7][c:8]1[c:9]([cH:13][cH:14][cH:15][cH:16]1)[N:10]=[C:11]2[NH2:12].[ClH:1]>>[Cl:2][c:3]1[cH:4][c:5]2[c:6]([cH:17][cH:18]1)[NH:7][c:8]1[c:9]([cH:13][cH:14][cH:15][cH:16]1)[N:10]=[C:11]2[N:12]1[CH2:26][CH2:25][NH:24][CH:23]([CH2:22][CH2:21][O:20][CH3:19])[CH2:28]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 1140TolueneHCID 8857Ethyl AcetateHCID 81531DiisopropylethylamineHCID 178066642-(2-Methoxyethyl)piperazineHCID 69209861HCID 69209861, compound

Product 1

HCID 69210669HCID 69210669, compound

Sources & evidence

ORD record
ord-e30a4a1d9465418c92c43493510be6e9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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