Methanol → methyl 2-({4-[(methylamino)methyl]-2-phenyl-1H-pyrrol-1-yl}sulfonyl)benzoate

HRID 316360

Reaction equation

HRID 316360 reaction equation
[BH4-:31].[CH3:27][OH:28].[CH3:29][NH2:30].[CH3:34][OH:35].[CH:1](=[O:2])[c:3]1[cH:4][c:5](-[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[n:6]([S:8](=[O:9])(=[O:10])[c:11]2[c:12]([C:13](=[O:14])[O:15][CH3:16])[cH:17][cH:18][cH:19][cH:20]2)[cH:7]1.[Na+:32].[OH2:33]>>[CH2:1]([c:3]1[cH:4][c:5](-[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[n:6]([S:8](=[O:9])(=[O:10])[c:11]2[c:12]([C:13](=[O:14])[O:15][CH3:16])[cH:17][cH:18][cH:19][cH:20]2)[cH:7]1)[NH:30][CH3:29]

Participants

7

Reactant 6

HCID 887Methanol2×HCID 923Sodium ionHCID 962WaterHCID 6329MethylamineHCID 28123BorohydrideHCID 86620753Methyl 2-[(4-formyl-2-phenyl-1H-pyrrol-1-yl)sulfonyl]benzoate

Product 1

HCID 66925025methyl 2-({4-[(methylamino)methyl]-2-phenyl-1H-pyrrol-1-yl}sulfonyl)benzoate

Sources & evidence

ORD record
ord-f6bcca432b0c4ca9818eadd2206d0e6f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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