Dimethyl Sulfoxide → HCID 66936991, compound

HRID 2126402Notes

Reaction equation

HRID 2126402 reaction equation
[C:31](=[O:32])([O-:33])[O-:34].[CH3:37][c:38]1[cH:39][cH:40][c:41]([S:42]([O:43][CH2:44][CH:49]2[O:50][CH2:51][CH2:52]2)(=[O:45])=[O:46])[cH:47][cH:48]1.[CH3:53][S:54]([CH3:55])=[O:56].[K+:35].[K+:36].[NH2:1][CH:2]1[CH2:3][CH2:4][CH:5]([NH:8][c:9]2[n:10][cH:11][c:12]([Cl:30])[c:13](-[c:15]3[n:16][c:17]([NH:22][CH2:23][CH:24]4[CH2:25][CH2:26][O:27][CH2:28][CH2:29]4)[c:18]([F:21])[cH:19][cH:20]3)[cH:14]2)[CH2:6][CH2:7]1.[OH2:57]>>[N:1]([CH:2]1[CH2:3][CH2:4][CH:5]([NH:8][c:9]2[n:10][cH:11][c:12]([Cl:30])[c:13](-[c:15]3[n:16][c:17]([NH:22][CH2:23][CH:24]4[CH2:25][CH2:26][O:27][CH2:28][CH2:29]4)[c:18]([F:21])[cH:19][cH:20]3)[cH:14]2)[CH2:6][CH2:7]1)([CH3:31])[CH:49]1[O:50][CH2:51][CH2:52]1

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 962WaterHCID 19660Carbonate IonHCID 13927594Oxetan-2-ylmethyl 4-methylbenzenesulfonateHCID 50906396HCID 50906396, compound

Product 1

HCID 66936991HCID 66936991, compound

Sources & evidence

ORD record
ord-08a29cb9c314461f91eee4115bd43f32
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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