Potassium Cation → 5-chloro-1,3-dihydro-1-{1-[3-(2-oxo-3(2H)-benzothiazolyl)propyl]-4-piperidinyl}-2H-benzimidazol-2-one

HRID 1121353

Reaction equation

HRID 1121353 reaction equation
[Br:1][CH2:2][CH2:3][CH2:4][n:5]1[c:6](=[O:14])[s:7][c:8]2[c:9]1[cH:10][cH:11][cH:12][cH:13]2.[CH3:41][CH:42]([CH3:43])[CH2:44][C:45](=[O:46])[CH3:47].[Cl:15][c:16]1[cH:17][c:18]2[c:19]([n:20]([CH:24]3[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]3)[c:21](=[O:23])[nH:22]2)[cH:30][cH:31]1.[I-:39].[K+:38].[Na+:32].[Na+:33].[O-:34][C:35](=[O:36])[O-:37].[OH2:40]>>[CH2:2]([CH2:3][CH2:4][n:5]1[c:6](=[O:14])[s:7][c:8]2[c:9]1[cH:10][cH:11][cH:12][cH:13]2)[N:27]1[CH2:26][CH2:25][CH:24]([n:20]2[c:19]3[c:18]([cH:17][c:16]([Cl:15])[cH:31][cH:30]3)[nH:22][c:21]2=[O:23])[CH2:29][CH2:28]1

Participants

9

Reactant 8

HCID 813Potassium CationHCID 923Sodium ion2×HCID 962WaterHCID 7909Methyl Isobutyl KetoneHCID 19660Carbonate IonHCID 30165Iodide IonHCID 1046075-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-oneHCID 214599273-(3-bromopropyl)-2(3H)-benzothiazolone

Product 1

HCID 203855725-chloro-1,3-dihydro-1-{1-[3-(2-oxo-3(2H)-benzothiazolyl)propyl]-4-piperidinyl}-2H-benzimidazol-2-one

Sources & evidence

ORD record
ord-e74a64acb2a24958a54bac5627af53ef
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Linked notes

Loading…