Acetic Acid → HCID 178482109, compound

HRID 2330352Notes

Reaction equation

HRID 2330352 reaction equation
[CH3:28][C:29](=[O:30])[OH:31].[CH3:4][S:5](=[O:6])[c:7]1[n:8][n:9]2[c:10]([cH:11][n:12]1)[cH:13][cH:14][c:15]2-[c:16]1[c:17]([N:22]([S:23](=[O:24])(=[O:25])[CH3:26])[CH3:27])[cH:18][cH:19][cH:20][cH:21]1.[Na+:2].[OH-:1].[OH2:3]>>[OH:1][c:7]1[n:8][n:9]2[c:10]([cH:11][n:12]1)[cH:13][cH:14][c:15]2-[c:16]1[c:17]([N:22]([S:23](=[O:24])(=[O:25])[CH3:26])[CH3:27])[cH:18][cH:19][cH:20][cH:21]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 54577677N-[2-(2-M ethanesulfinyl-pyrrolo[2,1-f][1,2,4]triazin-7-yl)-phenyl]-N-methyl-methanesulfonamide

Product 1

HCID 178482109HCID 178482109, compound

Sources & evidence

ORD record
ord-2283ab5371944d439341b20887095484
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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