Sodium ion → HCID 15037413, compound

HRID 321520Notes

Reaction equation

HRID 321520 reaction equation
[CH3:37][N:38]([CH3:39])[C:40](=[O:41])[CH3:42].[Cl:1][CH2:2][CH2:3][NH:4][C:5]([O:6][CH2:7][CH3:8])=[O:9].[NH:10]1[CH2:11][CH:12]([NH:15][c:16]2[n:17][c:18]3[c:19]([n:20][cH:21][cH:22][cH:23]3)[n:24]2[CH2:25][c:26]2[s:27][cH:28][cH:29][cH:30]2)[CH2:13][CH2:14]1.[Na+:31].[Na+:32].[O-:33][C:34](=[O:35])[O-:36].[OH2:43]>>[CH2:2]([CH2:3][NH:4][C:5]([O:6][CH2:7][CH3:8])=[O:9])[N:10]1[CH2:11][CH:12]([NH:15][c:16]2[n:17][c:18]3[c:19]([n:20][cH:21][cH:22][cH:23]3)[n:24]2[CH2:25][c:26]2[s:27][cH:28][cH:29][cH:30]2)[CH2:13][CH2:14]1

Participants

7

Reactant 6

HCID 923Sodium ion2×HCID 962WaterHCID 19660Carbonate IonHCID 31374DimethylacetamideHCID 80621Ethyl 2-chloroethylcarbamateHCID 15037383HCID 15037383, compound

Product 1

HCID 15037413HCID 15037413, compound

Sources & evidence

ORD record
ord-2858705ec95c45b6a9ec05167406e9b5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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