Dimethyl Sulfoxide → HCID 57478107, compound

HRID 1222177Notes

Reaction equation

[CH3:1][S:2]([O:3][CH2:6][CH:7]1[CH2:8][CH2:9][CH:10]([n:13]2[n:14][cH:15][c:16](-[c:18]3[c:19]4[c:20]([n:21][cH:22][n:23]3)[n:24]([CH2:27][O:28][CH2:29][CH2:30][Si:31]([CH3:32])([CH3:33])[CH3:34])[cH:25][cH:26]4)[cH:17]2)[CH2:11][CH2:12]1)(=[O:4])=[O:5].[CH3:39][S:40]([CH3:41])=[O:42].[K+:35].[S-:36][C:37]#[N:38]>>[CH2:6]([CH:7]1[CH2:8][CH2:9][CH:10]([n:13]2[n:14][cH:15][c:16](-[c:18]3[c:19]4[c:20]([n:21][cH:22][n:23]3)[n:24]([CH2:27][O:28][CH2:29][CH2:30][Si:31]([CH3:32])([CH3:33])[CH3:34])[cH:25][cH:26]4)[cH:17]2)[CH2:11][CH2:12]1)[S:36][C:37]#[N:38]

Participants

Reactant 4

HCID 679Dimethyl Sulfoxide

HCID 813Potassium Cation

HCID 9322Thiocyanate

HCID 57477964cis-4-[4-(7-[2-(Trimethylsilyl)ethoxy]methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]cyclohexylmethyl methanesulfonate

Product 1

HCID 57478107HCID 57478107, compound

Sources & evidence

ORD record: ord-785b1f749afe4989a50945d4def56571
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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