Potassium Cation → 5-[5-(Cyclopropylmethyl)-3-thienyl]-3-(1,1-dioxidotetrahydro-2H-thiopyran-4-yl)-1H-indole-7-carboxamide

HRID 302938Notes

Reaction equation

HRID 302938 reaction equation
[Br:1][c:2]1[cH:3][c:4]([CH2:7][CH:8]2[CH2:9][CH2:10]2)[s:5][cH:6]1.[CH2:47]1[O:48][CH2:49][CH2:50][O:51][CH2:52]1.[K+:40].[K+:41].[O-:42][C:43]([O-:44])=[O:45].[O:11]=[S:12]1(=[O:39])[CH2:13][CH2:14][CH:15]([c:18]2[cH:19][nH:20][c:21]3[c:22]([C:36](=[O:37])[NH2:38])[cH:23][c:24]([B:27]4[O:28][C:29]([CH3:30])([CH3:31])[C:32]([CH3:33])([CH3:34])[O:35]4)[cH:25][c:26]23)[CH2:16][CH2:17]1.[OH2:46]>>[c:2]1(-[c:24]2[cH:23][c:22]([C:36](=[O:37])[NH2:38])[c:21]3[nH:20][cH:19][c:18]([CH:15]4[CH2:14][CH2:13][S:12](=[O:11])(=[O:39])[CH2:17][CH2:16]4)[c:26]3[cH:25]2)[cH:3][c:4]([CH2:7][CH:8]2[CH2:9][CH2:10]2)[s:5][cH:6]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 962WaterHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 593327113-(1,1-dioxidotetrahydro-2H-thiopyran-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-7-carboxamideHCID 593327134-Bromo-2-(cyclopropylmethyl)thiophene

Product 1

HCID 593327805-[5-(Cyclopropylmethyl)-3-thienyl]-3-(1,1-dioxidotetrahydro-2H-thiopyran-4-yl)-1H-indole-7-carboxamide

Sources & evidence

ORD record
ord-064bad6bce714d0999e5ecc3b3ec0e11
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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