Dimethyl Sulfoxide → HCID 59420858, compound

HRID 2157303Notes

Reaction equation

HRID 2157303 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:11][C:12](=[O:13])[NH:14][c:15]2[cH:16][c:17]([F:28])[cH:18][c:19]([O:21][CH:22]3[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]3)[cH:20]2)[n:8]([CH3:10])[n:9]1.[C:48](=[O:49])([OH:50])[O-:51].[CH3:53][S:54]([CH3:55])=[O:56].[CH3:57][CH2:58][O:59][C:60](=[O:61])[CH3:62].[CH:39]([N:40]([CH2:41][CH3:42])[CH:43]([CH3:44])[CH3:45])([CH3:46])[CH3:47].[Na+:52].[c:29]1([O:35][C:36](=[O:30])[NH2:37])[cH:31][cH:32][cH:33][cH:34][cH:38]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:11][C:12](=[O:13])[NH:14][c:15]2[cH:16][c:17]([F:28])[cH:18][c:19]([O:21][CH:22]3[CH2:23][CH2:24][N:25]([C:36](=[O:35])[NH2:37])[CH2:26][CH2:27]3)[cH:20]2)[n:8]([CH3:10])[n:9]1

Participants

8

Reactant 7

HCID 679Dimethyl SulfoxideHCID 769Bicarbonate IonHCID 923Sodium ionHCID 8857Ethyl AcetateHCID 69322Phenyl carbamateHCID 81531DiisopropylethylamineHCID 68457459HCID 68457459, compound

Product 1

HCID 59420858HCID 59420858, compound

Sources & evidence

ORD record
ord-853070a6b95b4fab9d1326a9053c7785
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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