Dimethyl Sulfoxide → HCID 20513415, compound

Reaction equation

[CH3:25][S:26]([CH3:27])=[O:28].[CH3:6][O:7][c:8]1[c:9]([O:16][c:17]2[c:18]([CH3:23])[cH:19][cH:20][cH:21][cH:22]2)[cH:10][cH:11][cH:12][c:13]1[CH2:14][Cl:15].[I-:5].[K:1][C:2]#[N:3].[Na+:4].[OH2:24]>>[C:2](#[N:3])[CH2:14][c:13]1[c:8]([O:7][CH3:6])[c:9]([O:16][c:17]2[c:18]([CH3:23])[cH:19][cH:20][cH:21][cH:22]2)[cH:10][cH:11][cH:12]1

Participants

Reactant 6

HCID 679Dimethyl Sulfoxide

HCID 923Sodium Ion

HCID 962Water

HCID 30165Iodide Ion

HCID 20513505HCID 20513505, compound

HCID 178511842HCID 178511842, compound

Product 1

HCID 20513415HCID 20513415, compound

Sources & evidence

ORD record: ord-6db29ea6db664f96bccd48d6361b51dd
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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