Acetic Acid → HCID 13115810, compound

HRID 2316595Notes

Reaction equation

HRID 2316595 reaction equation
[CH2:1]([O:2][C:4](=[O:5])[c:6]1[c:7]([NH:18][c:19]2[c:20]([NH2:25])[cH:21][cH:22][cH:23][cH:24]2)[n:8][c:9](-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[n:10][cH:11]1)[CH3:3].[CH3:27][C:28](=[O:29])[OH:30].[CH3:32][CH2:33][OH:34].[Na:26].[OH2:31]>>[C:4]1(=[O:5])[c:6]2[c:7]([n:8][c:9](-[c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)[n:10][cH:11]2)[NH:18][c:19]2[c:20]([cH:21][cH:22][cH:23][cH:24]2)[NH:25]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 702EthanolHCID 962WaterHCID 5360545SodiumHCID 20554387Ethyl 4-[(2-aminophenyl)amino]-2-phenyl-5-pyrimidinecarboxylate

Product 1

HCID 13115810HCID 13115810, compound

Sources & evidence

ORD record
ord-f6623165468a4b73bdd1f19d7fd867f1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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