Dimethyl Sulfoxide → HCID 68693444, compound

HRID 297939Notes

Reaction equation

HRID 297939 reaction equation
[CH2:38]([N:39]([CH:40]([CH3:41])[CH3:42])[CH:43]([CH3:44])[CH3:45])[CH3:46].[CH3:1][S:2]([CH3:3])=[O:4].[Cl:24][CH2:25][CH2:26][CH2:27][O:28][c:29]1[cH:30][c:31]([F:37])[c:32]([C:33]#[N:34])[cH:35][cH:36]1.[F:5][c:6]1[c:7]([C:8]#[N:9])[cH:10][cH:11][c:12]([O:14][CH2:15][CH2:16][CH2:17][CH:18]2[CH2:19][CH2:20][NH:21][CH2:22][CH2:23]2)[cH:13]1.[OH2:47]>>[F:5][c:6]1[c:7]([C:8]#[N:9])[cH:10][cH:11][c:12]([O:14][CH2:15][CH2:16][CH2:17][CH:18]2[CH2:19][CH2:20][N:21]([CH2:25][CH2:26][CH2:27][O:28][c:29]3[cH:30][c:31]([F:37])[c:32]([C:33]#[N:34])[cH:35][cH:36]3)[CH2:22][CH2:23]2)[cH:13]1

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 962WaterHCID 81531DiisopropylethylamineHCID 18539959HCID 18539959, compoundHCID 59263044HCID 59263044, compound

Product 1

HCID 68693444HCID 68693444, compound

Sources & evidence

ORD record
ord-f231fe4d46e34894a156509be72e9034
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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