Methanesulfonic Acid → HCID 178452494, compound

HRID 142833Notes

Reaction equation

HRID 142833 reaction equation
[Br:31][c:32]1[cH:33][c:34]([C:39]([F:40])([F:41])[F:42])[c:35]([SH:38])[cH:36][cH:37]1.[C:6]([CH3:7])([CH3:8])([CH3:9])[O:10][C:11](=[O:12])[N:13]1[CH:14]([C:23]([NH:24][C:25]2([C:28]#[N:29])[CH2:26][CH2:27]2)=[O:30])[CH2:15][CH:16]([O:18][S:19]([CH3:20])(=[O:21])=[O:22])[CH2:17]1.[CH3:1][S:2]([OH:3])(=[O:4])=[O:5]>>[C:6]([CH3:7])([CH3:8])([CH3:9])[O:10][C:11](=[O:12])[N:13]1[CH:14]([C:23]([NH:24][C:25]2([C:28]#[N:29])[CH2:26][CH2:27]2)=[O:30])[CH2:15][CH:16]([S:38][c:35]2[c:34]([C:39]([F:40])([F:41])[F:42])[cH:33][c:32]([Br:31])[cH:37][cH:36]2)[CH2:17]1

Participants

4

Reactant 3

HCID 6395Methanesulfonic AcidHCID 509979974-Bromo-2-(trifluoromethyl)benzenethiolHCID 178452484tert-butyl 2-[(1-cyanocyclopropyl)carbamoyl]-4-methylsulfonyloxypyrrolidine-1-carboxylate

Product 1

HCID 178452494HCID 178452494, compound

Sources & evidence

ORD record
ord-701116f9cb6c41f8a919e2c5eb0e0e5e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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