Hydrochloric Acid → HCID 72340372, compound

HRID 146753Notes

Reaction equation

HRID 146753 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[N:14]2[CH2:15][c:16]3[c:17]([n:28][c:29]([C:32]([F:33])([F:34])[F:35])[cH:30][cH:31]3)[NH:18][c:19]3[c:20]2[cH:21][c:22]([C:25]([CH3:26])=[O:27])[cH:23][cH:24]3)[cH:9][cH:10]1.[CH3:45][CH2:46][OH:47].[ClH:36].[NH2:37][OH:38].[cH:39]1[cH:40][cH:41][n:42][cH:43][cH:44]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[N:14]2[CH2:15][c:16]3[c:17]([n:28][c:29]([C:32]([F:33])([F:34])[F:35])[cH:30][cH:31]3)[NH:18][c:19]3[c:20]2[cH:21][c:22]([C:25]([CH3:26])=[N:37][OH:38])[cH:23][cH:24]3)[cH:9][cH:10]1

Participants

6

Sources & evidence

ORD record
ord-1638716470a440b084fe654937409b83
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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