Hydrochloric Acid → HCID 58710069, compound

HRID 165552Notes

Reaction equation

HRID 165552 reaction equation
[C:38]([CH3:39])([CH3:40])([CH3:41])[N:42]=[C:43]=[O:44].[CH3:45][OH:46].[CH:29]([N:30]([CH2:31][CH3:32])[CH:33]([CH3:34])[CH3:35])([CH3:36])[CH3:37].[ClH:1].[ClH:2].[ClH:3].[O:47]=[CH:48][N:49]([CH3:50])[CH3:51].[s:4]1[cH:5][n:6][c:7]2[c:8]1[cH:9][cH:10][c:11]([NH:13][c:14]1[c:15]3[c:16]([n:17][cH:18][n:19]1)[nH:20][c:21]([C:23]1=[CH:28][CH2:27][NH:26][CH2:25][CH2:24]1)[cH:22]3)[cH:12]2>>[s:4]1[cH:5][n:6][c:7]2[c:8]1[cH:9][cH:10][c:11]([NH:13][c:14]1[c:15]3[c:16]([n:17][cH:18][n:19]1)[nH:20][c:21]([C:23]1=[CH:28][CH2:27][N:26]([C:43]([NH:42][C:38]([CH3:39])([CH3:40])[CH3:41])=[O:44])[CH2:25][CH2:24]1)[cH:22]3)[cH:12]2

Participants

7

Reactant 6

HCID 313Hydrochloric Acid3×HCID 887MethanolHCID 6228DimethylformamideHCID 62412tert-Butyl isocyanateHCID 81531DiisopropylethylamineHCID 58710058HCID 58710058, compound

Product 1

HCID 58710069HCID 58710069, compound

Sources & evidence

ORD record
ord-91033516be234c9c8f667d63f523caad
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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