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Pyrrolidine → N-(7-[1,4]Dioxepan-6-yl-4-methoxy-benzothiazol-2-yl)-4-pyrrolidin-1-ylmethyl-benzamide

HRID 2161632
Notes
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Reaction equation

HRID 2161632 reaction equation
[CH2:30]1[CH2:31][CH2:32][NH:33][CH2:34]1.[CH3:35][O:36][c:37]1[c:38]2[n:39][c:40]([NH:41][C:42](=[O:43])[c:44]3[cH:45][cH:46][c:47]([CH2:48][N:49]4[CH2:50][CH2:51][CH2:52][CH2:53]4)[cH:54][cH:55]3)[s:56][c:57]2[c:58](-[c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[cH:65][cH:66]1.[Cl:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[NH:9][c:10]2[s:11][c:12]3[c:13]([n:14]2)[c:15]([O:26][CH3:27])[cH:16][cH:17][c:18]3[CH:19]2[CH2:20][O:21][CH2:22][CH2:23][O:24][CH2:25]2)[cH:28][cH:29]1>>[CH2:2]([c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[NH:9][c:10]2[s:11][c:12]3[c:13]([n:14]2)[c:15]([O:26][CH3:27])[cH:16][cH:17][c:18]3[CH:19]2[CH2:20][O:21][CH2:22][CH2:23][O:24][CH2:25]2)[cH:28][cH:29]1)[N:33]1[CH2:32][CH2:31][CH2:30][CH2:34]1
ParticipantsSources & evidenceReaction notes

Participants

4

Reactant 3

HCID 31268PyrrolidineHCID 117508444-Chloromethyl-N-(7-[1,4]dioxepan-6-yl-4-methoxy-benzothiazol-2-yl)-benzamideHCID 22283140N-(4-methoxy-7-phenyl-benzothiazol-2-yl)-4-pyrrolidin-1-ylmethyl-benzamide

Product 1

HCID 86595145N-(7-[1,4]Dioxepan-6-yl-4-methoxy-benzothiazol-2-yl)-4-pyrrolidin-1-ylmethyl-benzamide

Sources & evidence

ORD record
ord-a665d8c7fb174c8daf62bf36a9034462
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes