Hydrochloric Acid → HCID 178527372, compound

HRID 170318Notes

Reaction equation

HRID 170318 reaction equation
[CH2:4]([c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[O:11][CH:12]1[CH:13]2[CH2:14][O:15][CH2:16][CH:17]([CH2:18]1)[N:19]2[CH2:20][CH:21]1[NH:22][CH2:23][CH2:24][NH:25][CH2:26]1.[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[Cl:43][CH2:44][Cl:45].[ClH:1].[ClH:2].[ClH:3].[s:34]1[c:35]([S:39](=[O:40])(=[O:41])[Cl:42])[cH:36][cH:37][cH:38]1>>[CH2:4]([c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[O:11][CH:12]1[CH:13]2[CH2:14][O:15][CH2:16][CH:17]([CH2:18]1)[N:19]2[CH2:20][CH:21]1[NH:22][CH2:23][CH2:24][N:25]([S:39]([c:35]2[s:34][cH:38][cH:37][cH:36]2)(=[O:40])=[O:41])[CH2:26]1

Participants

6

Reactant 5

HCID 313Hydrochloric Acid3×HCID 6344DichloromethaneHCID 8471TriethylamineHCID 855182-Thiophenesulfonyl chlorideHCID 706550146-Phenylmethoxy-8-(piperazin-2-ylmethyl)-3-oxa-8-azabicyclo[3.2.1]octane

Product 1

HCID 178527372HCID 178527372, compound

Sources & evidence

ORD record
ord-2dc2c9d5e161457ab0b7f121d8fcd763
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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