1,4-Dioxane → 5-[5-(Allyl-methyl-amino)-pentyl]-2,3-dihydro-indole-1-carbothioic acid O-(4-chloro-phenyl)ester

HRID 2153536Notes

Reaction equation

HRID 2153536 reaction equation
[CH2:1]([CH:2]=[CH2:3])[N:4]([CH3:5])[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][c:11]1[cH:12][c:13]2[c:17]([cH:18][cH:19]1)[NH:16][CH2:15][CH2:14]2.[Cl:20][c:21]1[cH:22][cH:23][c:24]([O:27][C:28](=[S:29])[Cl:30])[cH:25][cH:26]1.[O:31]1[CH2:32][CH2:33][O:34][CH2:35][CH2:36]1>>[CH2:1]([CH:2]=[CH2:3])[N:4]([CH3:5])[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][c:11]1[cH:12][c:13]2[c:17]([cH:18][cH:19]1)[N:16]([C:28]([O:27][c:24]1[cH:23][cH:22][c:21]([Cl:20])[cH:26][cH:25]1)=[S:29])[CH2:15][CH2:14]2

Participants

4

Reactant 3

HCID 312751,4-DioxaneHCID 70306O-p-Chlorophenyl chlorothioformateHCID 21966638Allyl-[5-(2,3-dihydro-1H-indol-5-yl)-pentyl]-methyl-amine

Product 1

HCID 99543375-[5-(Allyl-methyl-amino)-pentyl]-2,3-dihydro-indole-1-carbothioic acid O-(4-chloro-phenyl)ester

Sources & evidence

ORD record
ord-d42e1f4daa574e7c9ba86734dd3d66d2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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