Methanol → HCID 59708384, compound

HRID 175191Notes

Reaction equation

HRID 175191 reaction equation
[CH3:38][OH:39].[Cl:1][c:2]1[cH:3][c:4]([NH:8][c:9]2[c:10]3[c:11]([n:12][c:13]([N:15]4[CH2:16][CH2:17][N:18]([c:21]5[cH:22][cH:23][c:24]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[cH:30][cH:31]5)[CH2:19][CH2:20]4)[n:14]2)[CH2:32][CH2:33][S:34]3=[O:35])[cH:5][cH:6][cH:7]1.[Na+:37].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[OH-:36]>>[Cl:1][c:2]1[cH:3][c:4]([NH:8][c:9]2[c:10]3[c:11]([n:12][c:13]([N:15]4[CH2:16][CH2:17][N:18]([c:21]5[cH:22][cH:23][c:24]([C:25](=[O:26])[OH:27])[cH:30][cH:31]5)[CH2:19][CH2:20]4)[n:14]2)[CH2:32][CH2:33][S:34]3=[O:35])[cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 59708453ethyl 4-{4-[4-(3-chloro-phenylamino)-5-oxo-6,7-dihydro-5H-5lambda4-thieno[3,2-d]pyrimidin-2-yl]-piperazin-1-yl}-benzoate

Product 1

HCID 59708384HCID 59708384, compound

Sources & evidence

ORD record
ord-ac71265f854143de9585b2acf13a5cc2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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