Methane → HCID 178430319, compound

HRID 698801Notes

Reaction equation

HRID 698801 reaction equation
[CH3:29][CH2:30][N:31]([CH2:32][CH3:33])[CH2:34][CH3:35].[CH4:41].[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH2:7][C:8](=[O:9])[N:10]2[CH:11]([CH3:26])[CH2:12][N:13]([CH2:18][c:19]3[cH:20][cH:21][c:22]([F:25])[cH:23][cH:24]3)[CH:14]([CH2:16][OH:17])[CH2:15]2)[cH:27][cH:28]1.[Cl:47][CH2:48][Cl:49].[S:36]([Cl:37])([Cl:38])(=[O:39])=[O:40].[nH:42]1[n:43][n:44][n:45][cH:46]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH2:7][C:8](=[O:9])[N:10]2[CH:11]([CH3:26])[CH2:12][N:13]([CH2:18][c:19]3[cH:20][cH:21][c:22]([F:25])[cH:23][cH:24]3)[CH:14]([CH2:16][c:46]3[n:42][n:43][n:44][nH:45]3)[CH2:15]2)[cH:27][cH:28]1

Participants

7

Reactant 6

HCID 297MethaneHCID 6344DichloromethaneHCID 8471TriethylamineHCID 24648Sulfuryl chlorideHCID 22264323HCID 22264323, compoundHCID 178418441HCID 178418441, compound

Product 1

HCID 178430319HCID 178430319, compound

Sources & evidence

ORD record
ord-e4543b0187df437d99d30888722ff24c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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