Hydrochloric Acid → 3-[(2-Acetylamino-4-methyl-cyclohexanecarbonyl)-isopropyl-amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester

HRID 1213924Notes

Reaction equation

HRID 1213924 reaction equation
[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:8][c:9]1[N:10]([CH:11]([CH3:12])[CH3:13])[C:14](=[O:15])[CH:16]1[CH:17]([N:23]=[N+:24]=[N-:25])[CH2:18][CH:19]([CH3:22])[CH2:20][CH2:21]1.[CH3:41][C:42](=[O:43])[O:44][C:45](=[O:46])[CH3:47].[CH3:48][OH:49].[CH3:53][N:54]([c:55]1[cH:56][cH:57][n:58][cH:59][cH:60]1)[CH3:61].[Cl:50][CH2:51][Cl:52].[ClH:32].[H:33][H:34].[cH:35]1[cH:36][cH:37][n:38][cH:39][cH:40]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:8][c:9]1[N:10]([CH:11]([CH3:12])[CH3:13])[C:14](=[O:15])[CH:16]1[CH:17]([NH:23][C:42]([CH3:41])=[O:43])[CH2:18][CH:19]([CH3:22])[CH2:20][CH2:21]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 887MethanolHCID 1049PyridineHCID 6344DichloromethaneHCID 7918Acetic AnhydrideHCID 142844-(Dimethylamino)pyridineHCID 597523943-[(2-Azido-4-methyl-cyclohexanecarbonyl)-isopropyl-amino]-5-phenyl-thiophene-2-carboxylic acid methyl esterHCID 178418361HCID 178418361, compound

Product 1

HCID 597523653-[(2-Acetylamino-4-methyl-cyclohexanecarbonyl)-isopropyl-amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester

Sources & evidence

ORD record
ord-9824fc3f78d5428193d6020ebdc57b7d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…