Hydrochloric Acid → HCID 57690954, compound

HRID 2136752Notes

Reaction equation

HRID 2136752 reaction equation
[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH3:39][S:40](=[O:41])[CH3:42].[CH3:52][OH:53].[Cl:49][CH2:50][Cl:51].[ClH:1].[F:2][c:3]1[cH:4][cH:5][cH:6][c:7](-[c:9]2[cH:10][cH:11][c:12]3[n:13]([cH:14]2)[c:15]([CH2:18][O:19][c:20]2[cH:21][cH:22][n:23][c:24]4[cH:25][c:26]([O:30][CH3:31])[cH:27][cH:28][c:29]24)[n:16][n:17]3)[n:8]1.[O:43]1[CH2:44][CH2:45][O:46][CH2:47][CH2:48]1>>[c:3]1(=[O:41])[cH:4][cH:5][cH:6][c:7](-[c:9]2[cH:10][cH:11][c:12]3[n:13]([cH:14]2)[c:15]([CH2:18][O:19][c:20]2[cH:21][cH:22][n:23][c:24]4[cH:25][c:26]([O:30][CH3:31])[cH:27][cH:28][c:29]24)[n:16][n:17]3)[nH:8]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 887MethanolHCID 6344DichloromethaneHCID 8471TriethylamineHCID 312751,4-DioxaneHCID 67502414HCID 67502414, compound

Product 1

HCID 57690954HCID 57690954, compound

Sources & evidence

ORD record
ord-5a6595ddaf2641bca2cfdfa01220a4da
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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