Dimethyl Sulfoxide → 5-Fluoro-3-{1-[2,3,9,10-tetrahydro-8H-[1,4]dioxino[2,3-f]chromen-2-ylmethyl]-1,2,3,6-tetrahydro-4-pyridinyl}1H-indole

HRID 210639

Reaction equation

HRID 210639 reaction equation
[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:6]([O:7][CH2:12][CH:13]2[CH2:14][O:15][c:16]3[c:17]([c:18]4[c:23]([cH:24][cH:25]3)[O:22][CH2:21][CH2:20][CH2:19]4)[O:26]2)(=[O:8])=[O:9])[cH:10][cH:11]1.[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[CH3:49][S:50]([CH3:51])=[O:52].[F:27][c:28]1[cH:29][c:30]2[c:31]([C:37]3=[CH:42][CH2:41][NH:40][CH2:39][CH2:38]3)[cH:32][nH:33][c:34]2[cH:35][cH:36]1>>[CH2:12]([CH:13]1[CH2:14][O:15][c:16]2[c:17]([c:18]3[c:23]([cH:24][cH:25]2)[O:22][CH2:21][CH2:20][CH2:19]3)[O:26]1)[N:40]1[CH2:39][CH2:38][C:37]([c:31]2[c:30]3[cH:29][c:28]([F:27])[cH:36][cH:35][c:34]3[nH:33][cH:32]2)=[CH:42][CH2:41]1

Participants

5

Reactant 4

HCID 679Dimethyl SulfoxideHCID 8857Ethyl AcetateHCID 113449595-fluoro-3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indoleHCID 185460132,3,9,10-Tetrahydro-8H-[1,4]dioxino[2,3-f]chromen-2-ylmethyl 4-methylbenzenesulfonate

Product 1

HCID 102956415-Fluoro-3-{1-[2,3,9,10-tetrahydro-8H-[1,4]dioxino[2,3-f]chromen-2-ylmethyl]-1,2,3,6-tetrahydro-4-pyridinyl}1H-indole

Sources & evidence

ORD record
ord-0aaac61ae87841b0b3e9ef33545629f4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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