1-(1-Isopropylpyrrolidin-3-yl)-N-methylmethanamine → N-methyl-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]-8-(1H-pyrazol-4-yl)-4,5-dihydro-[1]benzoxepino[5,4-d][1,3]thiazole-2-carboxamide

HRID 143246Notes

Reaction equation

HRID 143246 reaction equation
[CH:23]([CH3:24])([CH3:25])[N:26]1[CH2:27][CH:28]([CH2:31][NH:32][CH3:33])[CH2:29][CH2:30]1.[nH:1]1[n:2][cH:3][c:4](-[c:6]2[cH:7][c:8]3[c:9]([cH:21][cH:22]2)-[c:10]2[n:11][c:12]([C:18](=[O:19])[OH:20])[s:13][c:14]2[CH2:15][CH2:16][O:17]3)[cH:5]1>>[nH:1]1[n:2][cH:3][c:4](-[c:6]2[cH:7][c:8]3[c:9]([cH:21][cH:22]2)-[c:10]2[n:11][c:12]([C:18](=[O:20])[N:32]([CH2:31][CH:28]4[CH2:27][N:26]([CH:23]([CH3:24])[CH3:25])[CH2:30][CH2:29]4)[CH3:33])[s:13][c:14]2[CH2:15][CH2:16][O:17]3)[cH:5]1

Participants

3

Reactant 2

HCID 179990881-(1-Isopropylpyrrolidin-3-yl)-N-methylmethanamineHCID 582038838-(1H-Pyrazol-4-yl)-4,5-dihydro-6-oxa-3-thia-1-aza-benzo[e]azulene-2-carboxylic acid

Product 1

HCID 76701913N-methyl-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]-8-(1H-pyrazol-4-yl)-4,5-dihydro-[1]benzoxepino[5,4-d][1,3]thiazole-2-carboxamide

Sources & evidence

ORD record
ord-b8bba2572d4f4a9dab826ac9d9077ad5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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