Hydrochloric Acid → HCID 66850447, compound

HRID 200325Notes

Reaction equation

HRID 200325 reaction equation
[CH3:25][N:26]([CH2:27][CH:28]=[CH:29][C:30](=[O:31])[OH:32])[CH3:33].[Cl:2][c:3]1[c:4]([NH:10][c:11]2[c:12]3[c:13]([n:14][cH:15][n:16]2)[s:17][c:18]2[c:19]3[CH2:20][CH2:21][NH:22][CH2:23]2)[cH:5][c:6]([OH:9])[cH:7][cH:8]1.[ClH:1].[ClH:24]>>[Cl:2][c:3]1[c:4]([NH:10][c:11]2[c:12]3[c:13]([n:14][cH:15][n:16]2)[s:17][c:18]2[c:19]3[CH2:20][CH2:21][N:22]([C:30]([CH:29]=[CH:28][CH2:27][N:26]([CH3:25])[CH3:33])=[O:31])[CH2:23]2)[cH:5][c:6]([OH:9])[cH:7][cH:8]1

Participants

4

Reactant 3

HCID 313Hydrochloric Acid2×HCID 533952454-(Dimethylamino)but-2-enoic acidHCID 581168104-Chloro-3-(8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-ylamino)phenol

Product 1

HCID 66850447HCID 66850447, compound

Sources & evidence

ORD record
ord-888f41b234e5487e82473162fead0976
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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