Benzene → HCID 178450757, compound

HRID 215430Notes

Reaction equation

HRID 215430 reaction equation
[CH3:57][S:58]([CH3:59])=[O:60].[CH:1]1([N:2]=[C:3]=[N:4][CH:5]2[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]2)[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]1.[OH:50][C:51]([C:52]([F:53])([F:54])[F:55])=[O:56].[c:22]1([CH2:28][C:29](=[O:30])[NH:31][CH:32]2[CH:33]3[N:34]([CH:35]([C:41](=[O:42])[O:43][C:44]([CH3:45])([CH3:46])[CH3:47])[CH:36]([CH2:39][OH:40])[CH2:37][S:38]3)[C:48]2=[O:49])[cH:23][cH:24][cH:25][cH:26][cH:27]1.[cH:16]1[cH:17][cH:18][n:19][cH:20][cH:21]1.[cH:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1>>[c:22]1([CH2:28][C:29](=[O:30])[NH:31][CH:32]2[CH:33]3[N:34]([CH:35]([C:41](=[O:42])[O:43][C:44]([CH3:45])([CH3:46])[CH3:47])[CH:36]([CH:39]=[O:40])[CH2:37][S:38]3)[C:48]2=[O:49])[cH:23][cH:24][cH:25][cH:26][cH:27]1

Participants

7

Reactant 6

HCID 241BenzeneHCID 679Dimethyl SulfoxideHCID 1049PyridineHCID 6422Trifluoroacetic acidHCID 10868DicyclohexylcarbodiimideHCID 178450758HCID 178450758, compound

Product 1

HCID 178450757HCID 178450757, compound

Sources & evidence

ORD record
ord-4b3954c315bc465b9316540397a45dbc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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