Hydrochloric Acid → HCID 86633069, compound

HRID 1537704Notes

Reaction equation

HRID 1537704 reaction equation
[CH3:1][S:2]([CH3:3])=[O:4].[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[CH:5]1([NH:11][c:12]2[c:13]([F:33])[cH:14][c:15]3[c:16](=[O:32])[c:17]([CH2:27][CH2:28][CH2:29][CH2:30][OH:31])[cH:18][n:19]([CH:22]4[CH2:23][CH2:24][CH2:25][CH2:26]4)[c:20]3[cH:21]2)[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]1.[ClH:44].[OH2:45].[S:40](=[O:41])(=[O:42])=[O:43].[n:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[CH:5]1([NH:11][c:12]2[c:13]([F:33])[cH:14][c:15]3[c:16](=[O:32])[c:17]([CH2:27][CH2:28][CH2:29][CH:30]=[O:31])[cH:18][n:19]([CH:22]4[CH2:23][CH2:24][CH2:25][CH2:26]4)[c:20]3[cH:21]2)[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 962WaterHCID 1049PyridineHCID 8471TriethylamineHCID 24682Sulfur trioxideHCID 66637055HCID 66637055, compound

Product 1

HCID 86633069HCID 86633069, compound

Sources & evidence

ORD record
ord-0b4f5d878d444bbc932efc737eb58ce4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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