Isopropanol → HCID 21070469, compound

HRID 284461Notes

Reaction equation

HRID 284461 reaction equation
[CH:23]([CH3:24])([CH3:25])[N:26]1[CH2:27][CH2:28][N:29]([c:32]2[cH:33][cH:34][c:35]([NH2:38])[cH:36][cH:37]2)[CH2:30][CH2:31]1.[CH:39]([OH:40])([CH3:41])[CH3:42].[NH2:1][c:2]1[n:3][c:4]([S:18]([CH2:19][CH3:20])(=[O:21])=[O:22])[n:5][cH:6][c:7]1[C:8](=[O:9])[c:10]1[c:11]([O:16][CH3:17])[cH:12][cH:13][cH:14][cH:15]1>>[NH2:1][c:2]1[n:3][c:4]([NH:38][c:35]2[cH:34][cH:33][c:32]([N:29]3[CH2:28][CH2:27][N:26]([CH:23]([CH3:24])[CH3:25])[CH2:31][CH2:30]3)[cH:37][cH:36]2)[n:5][cH:6][c:7]1[C:8](=[O:9])[c:10]1[c:11]([O:16][CH3:17])[cH:12][cH:13][cH:14][cH:15]1

Participants

4

Reactant 3

HCID 3776IsopropanolHCID 91615454-[4-(Propan-2-yl)piperazin-1-yl]anilineHCID 11961965(4-Amino-2-ethanesulfonylpyrimidin-5-yl)-(2-methoxyphenyl)-methanone

Product 1

HCID 21070469HCID 21070469, compound

Sources & evidence

ORD record
ord-67c4f48a1bf7416ab4749762e89825f8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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