Ethanol → Tert-butyl 3-[5-[1-[1-(4-methoxyphenyl)ethyl]pyrrolidin-2-yl]-3-pyridinyl]indole-1-carboxylate

HRID 683186Notes

Reaction equation

HRID 683186 reaction equation
[C:31]([CH3:32])([CH3:33])([CH3:34])[O:35][C:36](=[O:37])[n:38]1[cH:39][c:40]([Br:47])[c:41]2[cH:42][cH:43][cH:44][cH:45][c:46]12.[C:48](=[O:49])([O-:50])[O-:51].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH:9]([CH3:10])[N:11]2[CH:12]([c:16]3[cH:17][n:18][cH:19][c:20]([B:22]4[O:23][C:24]([CH3:25])([CH3:26])[C:27]([CH3:28])([CH3:29])[O:30]4)[cH:21]3)[CH2:13][CH2:14][CH2:15]2)[cH:7][cH:8]1.[CH3:54][c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1.[CH3:61][CH2:62][OH:63].[Na+:52].[Na+:53]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH:9]([CH3:10])[N:11]2[CH:12]([c:16]3[cH:17][n:18][cH:19][c:20](-[c:40]4[cH:39][n:38]([C:36]([O:35][C:31]([CH3:32])([CH3:33])[CH3:34])=[O:37])[c:46]5[c:41]4[cH:42][cH:43][cH:44][cH:45]5)[cH:21]3)[CH2:13][CH2:14][CH2:15]2)[cH:7][cH:8]1

Participants

7

Reactant 6

HCID 702EthanolHCID 923Sodium ion2×HCID 1140TolueneHCID 19660Carbonate IonHCID 20097636tert-Butyl 3-bromo-1H-indole-1-carboxylateHCID 911311053-[1-[1-(4-Methoxyphenyl)ethyl]pyrrolidin-2-yl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

Product 1

HCID 66889941Tert-butyl 3-[5-[1-[1-(4-methoxyphenyl)ethyl]pyrrolidin-2-yl]-3-pyridinyl]indole-1-carboxylate

Sources & evidence

ORD record
ord-f0fe7e67e2ae48d2a9c5170ca53e6c37
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…