Hydrochloric Acid → HCID 67263599, compound

HRID 1537400Notes

Reaction equation

HRID 1537400 reaction equation
[CH3:22][O:23][c:24]1[c:25]([NH2:43])[cH:26][c:27]2[c:28]([cH:42]1)[CH2:29][CH2:30][N:31]([CH2:34][CH2:35][N:36]1[CH2:37][CH2:38][O:39][CH2:40][CH2:41]1)[CH2:32][CH2:33]2.[CH3:51][O:52][CH2:53][CH2:54][OH:55].[Cl:1][c:2]1[n:3][cH:4][c:5]([Cl:21])[c:6]([NH:8][c:9]2[c:10]([S:15](=[O:16])(=[O:17])[CH:18]([CH3:19])[CH3:20])[cH:11][cH:12][cH:13][cH:14]2)[n:7]1.[ClH:44].[O:45]1[CH2:46][CH2:47][O:48][CH2:49][CH2:50]1>>[c:2]1([NH:43][c:25]2[c:24]([O:23][CH3:22])[cH:42][c:28]3[c:27]([cH:26]2)[CH2:33][CH2:32][N:31]([CH2:34][CH2:35][N:36]2[CH2:37][CH2:38][O:39][CH2:40][CH2:41]2)[CH2:30][CH2:29]3)[n:3][cH:4][c:5]([Cl:21])[c:6]([NH:8][c:9]2[c:10]([S:15](=[O:16])(=[O:17])[CH:18]([CH3:19])[CH3:20])[cH:11][cH:12][cH:13][cH:14]2)[n:7]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 80192-MethoxyethanolHCID 312751,4-DioxaneHCID 597643782,5-dichloro-N-(2-((1-methylethyl)sulfonyl)phenyl)-4-pyrimidinamineHCID 672641368-Methoxy-3-(2-morpholin-4-yl-ethyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-7-ylamine

Product 1

HCID 67263599HCID 67263599, compound

Sources & evidence

ORD record
ord-5ab010f808f24ff9b469387fbb4dfa39
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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