Acetic Acid → HCID 5327897, compound

HRID 210273Notes

Reaction equation

HRID 210273 reaction equation
[CH3:33][C:34](=[O:35])[OH:36].[Cl:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[c:12]([n:13][c:14]([S:17]([CH3:18])(=[O:19])=[O:20])[n:15][cH:16]3)[n:21]([CH3:24])[c:22]2=[O:23])[c:4]([Cl:8])[cH:5][cH:6][cH:7]1.[NH2:25][c:26]1[cH:27][cH:28][cH:29][c:30]([OH:31])[cH:32]1.[OH2:37]>>[Cl:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[c:12]([n:13][c:14]([NH:25][c:26]4[cH:27][cH:28][cH:29][c:30]([OH:31])[cH:32]4)[n:15][cH:16]3)[n:21]([CH3:24])[c:22]2=[O:23])[c:4]([Cl:8])[cH:5][cH:6][cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 115683-AminophenolHCID 105961576-(2,6-Dichlorophenyl)-8-methyl-2-methylsulfonyl-8H-pyrido[2,3-d]pyrimidin-7-one

Product 1

HCID 5327897HCID 5327897, compound

Sources & evidence

ORD record
ord-aac3d92c58e44830bd482c9abf375bdd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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