Dimethyl Sulfoxide → HCID 59856821, compound

HRID 2147348Notes

Reaction equation

HRID 2147348 reaction equation
[CH3:31][N:32]([CH2:33][CH2:34][SH:35])[CH3:36].[CH3:37][C:38]([CH3:39])([O-:40])[CH3:41].[CH3:43][S:44]([CH3:45])=[O:46].[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH:10]([O:13][c:14]2[n:15][cH:16][n:17][c:18]([NH:22][c:23]3[c:24]([F:30])[cH:25][c:26]([I:29])[cH:27][cH:28]3)[c:19]2[C:20]#[N:21])[CH2:11][CH2:12]1.[Na+:42]>>[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH:10]([O:13][c:14]2[n:15][cH:16][n:17][c:18]([NH:22][c:23]3[c:24]([F:30])[cH:25][c:26]([S:35][CH2:34][CH2:33][N:32]([CH3:31])[CH3:36])[cH:27][cH:28]3)[c:19]2[C:20]#[N:21])[CH2:11][CH2:12]1

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 923Sodium ionHCID 25799CaptamineHCID 45749132-Methylpropan-2-olateHCID 67202884HCID 67202884, compound

Product 1

HCID 59856821HCID 59856821, compound

Sources & evidence

ORD record
ord-a1edf73e441d464780b2380a332a4a5f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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