Hydrochloric Acid → HCID 66712301, compound

HRID 2321212Notes

Reaction equation

HRID 2321212 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][S:6](=[O:7])(=[O:8])[c:9]1[cH:10][c:11](-[c:15]2[cH:16][cH:17][c:18]3[cH:19][n:20][c:21]([OH:24])[n:22][n:23]23)[cH:12][cH:13][cH:14]1.[CH3:34][N:35]([CH3:36])[CH:37]=[O:38].[CH3:39][c:40]1[o:41][c:42]2[c:43]([n:44]1)[cH:45][c:46]([NH2:49])[cH:47][cH:48]2.[CH:25]([N:26]([CH2:27][CH3:28])[CH:29]([CH3:30])[CH3:31])([CH3:32])[CH3:33].[ClH:50]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][S:6](=[O:7])(=[O:8])[c:9]1[cH:10][c:11](-[c:15]2[cH:16][cH:17][c:18]3[cH:19][n:20][c:21]([NH:49][c:46]4[cH:45][c:43]5[c:42]([o:41][c:40]([CH3:39])[n:44]5)[cH:48][cH:47]4)[n:22][n:23]23)[cH:12][cH:13][cH:14]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 81531DiisopropylethylamineHCID 7379202-Methyl-1,3-benzoxazol-5-amineHCID 178449976HCID 178449976, compound

Product 1

HCID 66712301HCID 66712301, compound

Sources & evidence

ORD record
ord-1039b72b82e0490087df372478ccbf36
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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