N-[5-(2-amino-1-hydroxyethyl)-2-hydroxyphenyl]methanesulphonamide → N-(4-{4-[(2-Hydroxy-2-{4-hydroxy-3-[(methylsulfonyl)amino]phenyl}ethyl)amino]-1-piperidineyl}phenyl)-5-(2-pyridinyl)-2-thiophenesulfonamide

HRID 2150825Notes

Reaction equation

HRID 2150825 reaction equation
[NH2:29][CH2:30][CH:31]([OH:32])[c:33]1[cH:34][cH:35][c:36]([OH:44])[c:37]([NH:39][S:40](=[O:41])(=[O:42])[CH3:43])[cH:38]1.[O:1]=[C:2]1[CH2:3][CH2:4][N:5]([c:8]2[cH:9][cH:10][c:11]([NH:14][S:15](=[O:16])(=[O:17])[c:18]3[s:19][c:20](-[c:23]4[n:24][cH:25][cH:26][cH:27][cH:28]4)[cH:21][cH:22]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1>>[CH:2]1([NH:29][CH2:30][CH:31]([OH:32])[c:33]2[cH:34][cH:35][c:36]([OH:44])[c:37]([NH:39][S:40](=[O:41])(=[O:42])[CH3:43])[cH:38]2)[CH2:3][CH2:4][N:5]([c:8]2[cH:9][cH:10][c:11]([NH:14][S:15](=[O:16])(=[O:17])[c:18]3[s:19][c:20](-[c:23]4[n:24][cH:25][cH:26][cH:27][cH:28]4)[cH:21][cH:22]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1

Participants

3

Reactant 2

HCID 9837752N-[5-(2-amino-1-hydroxyethyl)-2-hydroxyphenyl]methanesulphonamideHCID 865845695-Pyridin-2-yl-thiophene-2-sulfonic acid [4-(4-oxo-piperidin-1-yl)-phenyl]-amide

Product 1

HCID 22220439N-(4-{4-[(2-Hydroxy-2-{4-hydroxy-3-[(methylsulfonyl)amino]phenyl}ethyl)amino]-1-piperidineyl}phenyl)-5-(2-pyridinyl)-2-thiophenesulfonamide

Sources & evidence

ORD record
ord-fc2243773eb04c869996706ec8c64c5d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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