Hydrochloric Acid → N-[1-(6-chloro-1H-benzimidazol-2-yl)-2-[(2-methylpropan-2-yl)oxy]propyl]-4-(2,5-dihydropyrrole-1-carbonyl)-3-methylbenzamide

HRID 317638Notes

Reaction equation

HRID 317638 reaction equation
[B-:18]([F:19])([F:20])([F:21])[F:22].[C:49]([CH3:50])([CH3:51])([CH3:52])[O:53][CH:54]([CH:55]([c:56]1[n:57][c:58]2[c:59]([nH:60]1)[cH:61][cH:62][c:63]([Cl:65])[cH:64]2)[NH2:66])[CH3:67].[CH2:74]([OH:75])[CH3:76].[CH3:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[OH:7])[cH:8][cH:9][c:10]1[C:11](=[O:12])[N:13]1[CH2:14][CH:15]=[CH:16][CH2:17]1.[CH:40]([N:41]([CH:42]([CH3:43])[CH3:44])[CH2:45][CH3:46])([CH3:47])[CH3:48].[Cl:68].[Cl:77][CH2:78][Cl:79].[O:69]1[CH2:70][CH2:71][CH2:72][CH2:73]1.[n:23]1([O:24][C:25]([N:26]([CH3:27])[CH3:28])=[N+:29]([CH3:30])[CH3:31])[c:32]2[cH:33][cH:34][cH:35][cH:36][c:37]2[n:38][n:39]1>>[CH3:1][c:2]1[cH:3][c:4]([C:5](=[O:7])[NH:66][CH:55]([CH:54]([O:53][C:49]([CH3:50])([CH3:51])[CH3:52])[CH3:67])[c:56]2[n:57][c:58]3[c:59]([nH:60]2)[cH:61][cH:62][c:63]([Cl:65])[cH:64]3)[cH:8][cH:9][c:10]1[C:11](=[O:12])[N:13]1[CH2:14][CH:15]=[CH:16][CH2:17]1

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 702EthanolHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 26255TetrafluoroborateHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 118586383-Methyl-4-(2,5-dihydropyrrol-1-ylcarbonyl)benzoic acidHCID 178467784HCID 178467784, compound

Product 1

HCID 178427024N-[1-(6-chloro-1H-benzimidazol-2-yl)-2-[(2-methylpropan-2-yl)oxy]propyl]-4-(2,5-dihydropyrrole-1-carbonyl)-3-methylbenzamide

Sources & evidence

ORD record
ord-2140522f28684b64b895ec9cd693f172
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…