Chloride → HCID 67272676, compound

HRID 2312859Notes

Reaction equation

HRID 2312859 reaction equation
[CH2:59]1[O:60][CH2:61][CH2:62][CH2:63]1.[CH3:49][CH2:50][N:51]([CH2:52][CH3:53])[CH2:54][CH3:55].[Cl-:48].[Cl:12][C:13]([C:14]([Cl:15])=[O:16])=[O:17].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[c:7]([Cl:11])[cH:8][n:9][cH:10]1.[Cl:56][CH2:57][Cl:58].[NH2:18][CH2:19][c:20]1[cH:21][cH:22][c:23]([CH2:28][N:29]([CH:30]2[CH2:31][CH2:32][CH2:33][c:34]3[cH:35][cH:36][cH:37][n:38][c:39]32)[CH2:40][c:41]2[n:42][cH:43][cH:44][cH:45][c:46]2[NH2:47])[c:24]([CH2:26][OH:27])[cH:25]1.[O:64]=[CH:65][N:66]([CH3:67])[CH3:68]>>[Cl:1][c:2]1[c:3]([C:4](=[O:6])[NH:47][c:46]2[c:41]([CH2:40][N:29]([CH2:28][c:23]3[cH:22][cH:21][c:20]([CH2:19][NH2:18])[cH:25][c:24]3[CH2:26][OH:27])[CH:30]3[CH2:31][CH2:32][CH2:33][c:34]4[cH:35][cH:36][cH:37][n:38][c:39]43)[n:42][cH:43][cH:44][cH:45]2)[c:7]([Cl:11])[cH:8][n:9][cH:10]1

Participants

9

Reactant 8

HCID 312ChlorideHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 65578Oxalyl chlorideHCID 6057633,5-Dichloroisonicotinic acidHCID 58996975HCID 58996975, compound

Product 1

HCID 67272676HCID 67272676, compound

Sources & evidence

ORD record
ord-f4635ddc6c82431ab36145651bd3672b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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