Acetic Acid → HCID 21262613, compound

HRID 192937Notes

Reaction equation

HRID 192937 reaction equation
[CH3:20][O:21][c:22]1[cH:23][cH:24][c:25]([CH2:26][NH2:27])[cH:28][cH:29]1.[CH3:30][C:31](=[O:32])[OH:33].[CH3:34][OH:35].[CH3:36][N:37]1[CH2:38][CH2:39][CH2:40][N:41]([CH3:42])[C:43]1=[O:44].[Cl:1][c:2]1[cH:3][c:4]([NH:5][c:6]2[c:7]3[c:8]([n:9][cH:10][n:11]2)[nH:12][c:13]([CH:15]=[O:16])[cH:14]3)[cH:17][cH:18][cH:19]1>>[Cl:1][c:2]1[cH:3][c:4]([NH:5][c:6]2[c:7]3[c:8]([n:9][cH:10][n:11]2)[nH:12][c:13]([CH2:15][NH:27][CH2:26][c:25]2[cH:24][cH:23][c:22]([O:21][CH3:20])[cH:29][cH:28]2)[cH:14]3)[cH:17][cH:18][cH:19]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 887MethanolHCID 754524-MethoxybenzylamineHCID 816462(1H)-Pyrimidinone, tetrahydro-1,3-dimethyl-HCID 110976994-(3-chloroanilino)-6-formyl-7H-pyrrolo[2,3-d]pyrimidine

Product 1

HCID 21262613HCID 21262613, compound

Sources & evidence

ORD record
ord-6c2f56e06c874b0591b6b150461cc446
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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