Hydrochloric Acid → HCID 66967157, compound

HRID 680188Notes

Reaction equation

HRID 680188 reaction equation
[CH3:21][O:22][c:23]1[cH:24][cH:25][c:26]([C:29]([CH2:30][Br:31])=[O:32])[cH:27][cH:28]1.[CH:33]([N:34]([CH2:35][CH3:36])[CH:37]([CH3:38])[CH3:39])([CH3:40])[CH3:41].[ClH:47].[O:42]=[CH:43][N:44]([CH3:45])[CH3:46].[c:1]1([C:7]([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[SH:20])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[S:20][CH2:30][C:29]([c:26]2[cH:25][cH:24][c:23]([O:22][CH3:21])[cH:28][cH:27]2)=[O:32])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 4965Bromomethyl 4-methoxyphenyl ketoneHCID 6228DimethylformamideHCID 77281Benzenemethanethiol, alpha,alpha-diphenyl-HCID 81531Diisopropylethylamine

Product 1

HCID 66967157HCID 66967157, compound

Sources & evidence

ORD record
ord-cfe74083ee0443009522e1d64abbf81f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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