Water → HCID 66990363, compound

HRID 2161909Notes

Reaction equation

HRID 2161909 reaction equation
[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[CH3:60][N:61]([CH3:62])[CH:63]=[O:64].[Cl:1][C:2]([C:3]([Cl:4])=[O:5])=[O:6].[NH2:22][c:23]1[c:24]([C:25](=[O:26])[O:27][CH3:28])[cH:29][cH:30][c:31](-[c:33]2[c:34]([N:39]([CH2:40][CH3:41])[C:42](=[O:43])[O:44][C:45]([CH3:46])([CH3:47])[CH3:48])[cH:35][cH:36][cH:37][cH:38]2)[cH:32]1.[O:55]1[CH2:56][CH2:57][CH2:58][CH2:59]1.[OH2:71].[c:7]1(-[c:13]2[cH:14][c:15]([C:19](=[O:20])[OH:21])[cH:16][n:17][cH:18]2)[cH:8][cH:9][cH:10][cH:11][cH:12]1.[cH:65]1[cH:66][cH:67][n:68][cH:69][cH:70]1>>[c:7]1(-[c:13]2[cH:14][c:15]([C:19](=[O:21])[NH:22][c:23]3[c:24]([C:25](=[O:26])[O:27][CH3:28])[cH:29][cH:30][c:31](-[c:33]4[c:34]([N:39]([CH2:40][CH3:41])[C:42](=[O:43])[O:44][C:45]([CH3:46])([CH3:47])[CH3:48])[cH:35][cH:36][cH:37][cH:38]4)[cH:32]3)[cH:16][n:17][cH:18]2)[cH:8][cH:9][cH:10][cH:11][cH:12]1

Participants

9

Reactant 8

HCID 962WaterHCID 1049PyridineHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 65578Oxalyl chlorideHCID 3461605-Phenylnicotinic AcidHCID 66990413HCID 66990413, compound

Product 1

HCID 66990363HCID 66990363, compound

Sources & evidence

ORD record
ord-c29ea3b6b27442688c9e87e1224ef140
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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