methyl((1-methyl-1H-indol-2-yl)methyl)amine → HCID 178432183, compound

HRID 1573542Notes

Reaction equation

HRID 1573542 reaction equation
[C:51]([CH2:52][CH:53]1[C:54](=[O:55])[N:56]([CH3:57])[CH2:58][c:59]2[cH:60][c:61]([C:62]([OH:63])=[O:64])[cH:65][cH:66][c:67]2[NH:68]1)([O:69][CH3:70])=[O:71].[CH3:21][n:22]1[c:23]2[c:24]([cH:25][cH:26][cH:27][cH:28]2)[cH:29][c:30]1[CH2:31][NH:32][CH3:33].[CH3:34][CH:35]1[NH:36][c:37]2[c:38]([cH:44][c:45]([C:48](=[O:49])[OH:50])[cH:46][cH:47]2)[CH2:39][N:40]([CH3:43])[C:41]1=[O:42].[OH:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][n:7]2[c:8]([CH2:16][NH:17][CH3:18])[cH:9][c:10]3[cH:11][cH:12][cH:13][cH:14][c:15]23)[cH:19][cH:20]1>>[OH:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][n:7]2[c:8]([CH2:16][N:17]([CH3:18])[C:48]([c:45]3[cH:44][c:38]4[c:37]([cH:47][cH:46]3)[NH:36][CH:35]([CH3:34])[C:41](=[O:42])[N:40]([CH3:43])[CH2:39]4)=[O:50])[cH:9][c:10]3[cH:11][cH:12][cH:13][cH:14][c:15]23)[cH:19][cH:20]1

Participants

5

Reactant 4

HCID 11401058methyl((1-methyl-1H-indol-2-yl)methyl)amineHCID 23505570Methyl 7-carboxy-2,3,4,5-tetrahydro-4-methyl-3-oxo-1h-1,4-benzodiazepine-2-acetateHCID 235055811-(4-Hydroxybenzyl)-2-(methylaminomethyl)indoleHCID 178432184HCID 178432184, compound

Product 1

HCID 178432183HCID 178432183, compound

Sources & evidence

ORD record
ord-16d60f3db28d4f59b6bc2efb16208c75
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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