Dimethyl Sulfoxide → HCID 69316444, compound

HRID 284462Notes

Reaction equation

HRID 284462 reaction equation
[CH3:37][S:38]([CH3:39])=[O:40].[CH:1]1([n:6]2[cH:7][c:8](-[c:16]3[n:17][c:18]4[c:19]([nH:20]3)[cH:21][c:22]([N+:25]([O-:26])=[O:27])[cH:23][cH:24]4)[c:9]3[c:10]2[n:11][cH:12][n:13][c:14]3[NH2:15])[CH2:2][CH2:3][CH2:4][CH2:5]1.[O:28]=[C:29]=[N:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[CH:1]1([n:6]2[cH:7][c:8](-[c:16]3[n:17][c:18]4[c:19]([nH:20]3)[cH:21][c:22]([NH:25][C:29](=[O:28])[NH:30][c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[cH:23][cH:24]4)[c:9]3[c:10]2[n:11][cH:12][n:13][c:14]3[NH2:15])[CH2:2][CH2:3][CH2:4][CH2:5]1

Participants

4

Reactant 3

HCID 679Dimethyl SulfoxideHCID 7672Phenyl isocyanateHCID 69320502HCID 69320502, compound

Product 1

HCID 69316444HCID 69316444, compound

Sources & evidence

ORD record
ord-6d93b2e8eaaa43f6a4519276d97b7b6e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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