2-Propanol, 1-amino-2-methyl- → [2-(Propanoylamino)-1,3-benzothiazol-6-yl] 4-[(2-hydroxy-2-methylpropyl)amino]benzenesulfonate

HRID 666647Notes

Reaction equation

HRID 666647 reaction equation
[C:1]([CH2:2][CH3:3])(=[O:4])[NH:5][c:6]1[s:7][c:8]2[c:9]([n:10]1)[cH:11][cH:12][c:13]([O:15][S:16](=[O:17])(=[O:18])[c:19]1[cH:20][cH:21][c:22]([F:25])[cH:23][cH:24]1)[cH:14]2.[NH2:26][CH2:27][C:28]([CH3:29])([OH:30])[CH3:31]>>[C:1]([CH2:2][CH3:3])(=[O:4])[NH:5][c:6]1[s:7][c:8]2[c:9]([n:10]1)[cH:11][cH:12][c:13]([O:15][S:16](=[O:17])(=[O:18])[c:19]1[cH:20][cH:21][c:22]([NH:26][CH2:27][C:28]([CH3:29])([OH:30])[CH3:31])[cH:23][cH:24]1)[cH:14]2

Participants

3

Reactant 2

HCID 951022-Propanol, 1-amino-2-methyl-HCID 579808244-Fluorobenzenesulfonic acid 2-propionylaminobenzothiazol-6-yl ester

Product 1

HCID 57980822[2-(Propanoylamino)-1,3-benzothiazol-6-yl] 4-[(2-hydroxy-2-methylpropyl)amino]benzenesulfonate

Sources & evidence

ORD record
ord-965d3b55223147fe81e85aef2f2ee108
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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