Hydrochloric Acid → HCID 11604866, compound

HRID 2348388Notes

Reaction equation

HRID 2348388 reaction equation
[CH2:58]1[O:59][CH2:60][CH2:61][O:62][CH2:63]1.[CH3:27][C:28]#[N:29].[CH3:64][OH:65].[CH:30]([N:31]([CH2:32][CH3:33])[CH:34]([CH3:35])[CH3:36])([CH3:37])[CH3:38].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([C:11](=[O:12])[N:13]3[CH2:14][CH:15]([NH:18][C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:16][CH2:17]3)[CH2:9][CH2:10]2)[cH:6][cH:7]1.[Cl:39][c:40]1[c:41]([CH3:50])[c:42]([S:46](=[O:47])(=[O:48])[Cl:49])[cH:43][cH:44][cH:45]1.[ClH:26].[F:51][C:52]([F:53])([F:54])[C:55]([OH:56])=[O:57]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([C:11](=[O:12])[N:13]3[CH2:14][CH:15]([NH:18][S:46]([c:42]4[c:41]([CH3:50])[c:40]([Cl:39])[cH:45][cH:44][cH:43]4)(=[O:47])=[O:48])[CH2:16][CH2:17]3)[CH2:9][CH2:10]2)[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 887MethanolHCID 6342AcetonitrileHCID 6422Trifluoroacetic acidHCID 312751,4-DioxaneHCID 81531DiisopropylethylamineHCID 5227343-Chloro-2-methylbenzenesulfonyl chlorideHCID 178452868HCID 178452868, compound

Product 1

HCID 11604866HCID 11604866, compound

Sources & evidence

ORD record
ord-55afd05914474a33ac806ed9361500da
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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