Pyridine → [5-[2-[Benzyl(methyl)amino]ethyl]-8-chloro-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate

HRID 674084Notes

Reaction equation

HRID 674084 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH:9]2[S:10][c:11]3[c:12]([cH:29][cH:30][c:31]([Cl:33])[cH:32]3)[N:13]([CH2:18][CH2:19][N:20]([CH3:21])[CH2:22][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[C:14](=[O:17])[CH:15]2[OH:16])[cH:7][cH:8]1.[CH3:34][C:35](=[O:36])[O:37][C:38](=[O:39])[CH3:40].[cH:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH:9]2[S:10][c:11]3[c:12]([cH:29][cH:30][c:31]([Cl:33])[cH:32]3)[N:13]([CH2:18][CH2:19][N:20]([CH3:21])[CH2:22][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[C:14](=[O:17])[CH:15]2[O:16][C:35]([CH3:34])=[O:36])[cH:7][cH:8]1

Participants

4

Reactant 3

HCID 1049PyridineHCID 7918Acetic AnhydrideHCID 136040045-[2-[Benzyl(methyl)amino]ethyl]-8-chloro-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one

Product 1

HCID 13604016[5-[2-[Benzyl(methyl)amino]ethyl]-8-chloro-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate

Sources & evidence

ORD record
ord-c013b54c489a440a86f7c03d05f42ce2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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