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

HRID 678523Notes

Reaction equation

HRID 678523 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:32][cH:33][c:34]([CH3:36])[cH:35]3)[N:13]([CH2:18][CH2:19][N:20]([CH3:21])[C:22](=[O:23])[O:24][CH2:25][c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[C:14](=[O:17])[CH:15]2[OH:16])[cH:7][cH:8]1.[CH3:37][C:38](=[O:39])[O:40][C:41](=[O:42])[CH3:43].[cH:44]1[cH:45][cH:46][n:47][cH:48][cH:49]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:32][cH:33][c:34]([CH3:36])[cH:35]3)[N:13]([CH2:18][CH2:19][N:20]([CH3:21])[C:22](=[O:23])[O:24][CH2:25][c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[C:14](=[O:17])[CH:15]2[O:16][C:38]([CH3:37])=[O:39])[cH:7][cH:8]1

Participants

4

Reactant 3

HCID 1049PyridineHCID 7918Acetic AnhydrideHCID 13652762benzyl N-[2-[3-hydroxy-2-(4-methoxyphenyl)-8-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]ethyl]-N-methylcarbamate

Product 1

HCID 13652763[2-(4-Methoxyphenyl)-8-methyl-5-[2-[methyl(phenylmethoxycarbonyl)amino]ethyl]-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate

Sources & evidence

ORD record
ord-76a142a59c4a46dea2d88d961fe198be
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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