Dimethyl Sulfoxide → 4-Amino-3-{5-[5-(4-chloro-benzyl)-[1,3,4]oxadiazol-2-yl]-2-methyl-phenoxymethyl}-thieno[3,2-c]pyridine-7-carboxylic acid (2-hydroxy-ethyl)-amide

HRID 171206Notes

Reaction equation

HRID 171206 reaction equation
[CH2:1]([O:2][C:4](=[O:5])[c:6]1[c:7]2[c:8]([c:9]([NH2:12])[n:10][cH:11]1)[c:13]([CH2:16][O:17][c:18]1[c:19]([CH3:37])[cH:20][cH:21][c:22](-[c:24]3[o:25][c:26]([CH2:29][c:30]4[cH:31][cH:32][c:33]([Cl:36])[cH:34][cH:35]4)[n:27][n:28]3)[cH:23]1)[cH:14][s:15]2)[CH3:3].[CH3:42][S:43]([CH3:44])=[O:45].[NH2:38][CH2:39][CH2:40][OH:41]>>[C:4](=[O:5])([c:6]1[c:7]2[c:8]([c:9]([NH2:12])[n:10][cH:11]1)[c:13]([CH2:16][O:17][c:18]1[c:19]([CH3:37])[cH:20][cH:21][c:22](-[c:24]3[o:25][c:26]([CH2:29][c:30]4[cH:31][cH:32][c:33]([Cl:36])[cH:34][cH:35]4)[n:27][n:28]3)[cH:23]1)[cH:14][s:15]2)[NH:38][CH2:39][CH2:40][OH:41]

Participants

4

Reactant 3

HCID 679Dimethyl SulfoxideHCID 700EthanolamineHCID 24810242HCID 24810242, compound

Product 1

HCID 248102854-Amino-3-{5-[5-(4-chloro-benzyl)-[1,3,4]oxadiazol-2-yl]-2-methyl-phenoxymethyl}-thieno[3,2-c]pyridine-7-carboxylic acid (2-hydroxy-ethyl)-amide

Sources & evidence

ORD record
ord-6cec3ca6b50b443e9d56469801749f6e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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