Chloride → HCID 9950286, compound

HRID 193772Notes

Reaction equation

HRID 193772 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][c:9]1[n:10][c:11]2[c:12](=[O:22])[c:13]([C:19](=[O:20])[OH:21])[cH:14][nH:15][c:16]2[cH:17][cH:18]1.[CH2:36]([CH2:37][CH2:38][CH3:39])[NH2:40].[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[CH3:43][N:44]([CH3:45])[CH:46]=[O:47].[Cl-:42].[Cl:30][C:31]([O:32][CH2:33][CH3:34])=[O:35].[Na+:41]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][c:9]1[n:10][c:11]2[c:12](=[O:22])[c:13]([C:19](=[O:21])[NH:40][CH2:36][CH2:37][CH2:38][CH3:39])[cH:14][nH:15][c:16]2[cH:17][cH:18]1

Participants

8

Reactant 7

HCID 312ChlorideHCID 923Sodium ionHCID 6228DimethylformamideHCID 8007ButylamineHCID 8471TriethylamineHCID 10928Ethyl chloroformateHCID 18000177HCID 18000177, compound

Product 1

HCID 9950286HCID 9950286, compound

Sources & evidence

ORD record
ord-3204fe3aad7040299b073d263bedf74b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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