Acetic Acid → HCID 178508880, compound

HRID 143649Notes

Reaction equation

HRID 143649 reaction equation
[CH3:27][CH2:28][OH:29].[CH3:30][C:31](=[O:32])[OH:33].[NH2:1][c:2]1[n:3][c:4]([Cl:12])[c:5]2[c:6]([n:7]1)[CH2:8][CH2:9][CH2:10][S:11]2.[Na:25].[O:13]=[C:14]1[CH2:15][CH2:16][CH2:17][S:18][CH:19]1[C:20]([O:21][CH2:22][CH3:23])=[O:24].[OH2:26]>>[NH2:1][c:2]1[n:3][c:4]([OH:13])[c:5]2[c:6]([n:7]1)[CH2:8][CH2:9][CH2:10][S:11]2

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 702EthanolHCID 962WaterHCID 5360545SodiumHCID 12269128ethyl 3-oxotetrahydro-2H-thiopyran-2-carboxylateHCID 133071552-amino-4-chloro-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidine

Product 1

HCID 178508880HCID 178508880, compound

Sources & evidence

ORD record
ord-332025fd34b94662bcfd9dd284bf63fc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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