Dimethyl Sulfoxide → HCID 25254916, compound

HRID 2347704Notes

Reaction equation

HRID 2347704 reaction equation
[CH3:25][c:26]1[cH:27][c:28]([NH:36][CH2:37][CH2:38][NH2:39])[n:29][c:30]2[cH:31][cH:32][cH:33][cH:34][c:35]12.[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:47][S:48]([CH3:49])=[O:50].[NH2:1][c:2]1[c:3]2[c:4](=[O:24])[c:5]([C:21](=[O:22])[OH:23])[cH:6][n:7]3[c:8]2[c:9]([c:10]([F:13])[c:11]1[F:12])[O:14][CH2:15][C:16]31[CH2:17][CH2:18][CH2:19][CH2:20]1>>[NH2:1][c:2]1[c:3]2[c:4](=[O:24])[c:5]([C:21](=[O:22])[OH:23])[cH:6][n:7]3[c:8]2[c:9]([c:10]([NH:39][CH2:38][CH2:37][NH:36][c:28]2[cH:27][c:26]([CH3:25])[c:35]4[c:30]([n:29]2)[cH:31][cH:32][cH:33][cH:34]4)[c:11]1[F:12])[O:14][CH2:15][C:16]31[CH2:17][CH2:18][CH2:19][CH2:20]1

Participants

5

Reactant 4

HCID 679Dimethyl SulfoxideHCID 8471TriethylamineHCID 1847837N1-(4-methylquinolin-2-yl)ethane-1,2-diamineHCID 58134647HCID 58134647, compound

Product 1

HCID 25254916HCID 25254916, compound

Sources & evidence

ORD record
ord-5d61b84775a548bcb5ed7ab91a81c80a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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