Acetic Acid → HCID 67339893, compound

HRID 2313878Notes

Reaction equation

HRID 2313878 reaction equation
[C:20]([CH3:21])([CH3:22])([CH3:23])[O:24][C:25]([NH:26][c:27]1[cH:28][cH:29][c:30]([CH:33]=[O:34])[cH:31][cH:32]1)=[O:35].[CH3:36][C:37](=[O:38])[OH:39].[Cl:40][CH2:41][Cl:42].[N:1]1([c:7]2[cH:8][cH:9][c:10]3[n:11]([n:12]2)[c:13]([C:16]([F:17])([F:18])[F:19])[n:14][n:15]3)[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1>>[N:1]1([c:7]2[cH:8][cH:9][c:10]3[n:11]([n:12]2)[c:13]([C:16]([F:17])([F:18])[F:19])[n:14][n:15]3)[CH2:2][CH2:3][N:4]([CH2:33][c:30]2[cH:29][cH:28][c:27]([NH:26][C:25]([O:24][C:20]([CH3:21])([CH3:22])[CH3:23])=[O:35])[cH:32][cH:31]2)[CH2:5][CH2:6]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 6344DichloromethaneHCID 14768626-Piperazino-3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazineHCID 2771821tert-Butyl (4-formylphenyl)carbamate

Product 1

HCID 67339893HCID 67339893, compound

Sources & evidence

ORD record
ord-5168c4b17aa84d2cbda33b4481a60939
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…