Chloride → HCID 19603678, compound

HRID 1121462Notes

Reaction equation

HRID 1121462 reaction equation
[C:3]([CH3:4])([CH3:5])([CH3:6])[c:7]1[n:8][c:9](-[c:12]2[o:13][c:14]3[c:15]([cH:16]2)[cH:17][c:18]([CH2:21][n:22]2[cH:23][c:24]([CH:40]=[O:41])[c:25]4[cH:26][c:27]([O:31][CH2:32][CH2:33][CH2:34][C:35](=[O:36])[O:37][CH2:38][CH3:39])[cH:28][cH:29][c:30]24)[cH:19][cH:20]3)[s:10][cH:11]1.[CH3:45][C:46]([OH:47])([CH3:48])[CH3:49].[Cl-:2].[Na+:1].[Na:44].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[OH2:42].[SH2:43]>>[C:3]([CH3:4])([CH3:5])([CH3:6])[c:7]1[n:8][c:9](-[c:12]2[o:13][c:14]3[c:15]([cH:16]2)[cH:17][c:18]([CH2:21][n:22]2[cH:23][c:24]([C:40](=[O:41])[OH:42])[c:25]4[cH:26][c:27]([O:31][CH2:32][CH2:33][CH2:34][C:35](=[O:36])[O:37][CH2:38][CH3:39])[cH:28][cH:29][c:30]24)[cH:19][cH:20]3)[s:10][cH:11]1

Participants

9

Reactant 8

HCID 312ChlorideHCID 402Hydrogen SulfideHCID 923Sodium ionHCID 962WaterHCID 6386tert-ButanolHCID 8028TetrahydrofuranHCID 5360545SodiumHCID 19603778HCID 19603778, compound

Product 1

HCID 19603678HCID 19603678, compound

Sources & evidence

ORD record
ord-7f87e8bc92d34ff9b0f9702d44efc4b1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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