2-Methylpiperazine → (3-Methyl-piperazin-1-yl)-[8-(1H-pyrazol-4-yl)-4,5-dihydro-6-oxa-3-thia-1-aza-benzo[e]azulen-2-yl]-methanone

HRID 210444Notes

Reaction equation

HRID 210444 reaction equation
[CH3:23][CH:24]1[NH:25][CH2:26][CH2:27][NH:28][CH2:29]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>>[n:1]1[nH: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])[N:28]4[CH2:27][CH2:26][NH:25][CH:24]([CH3:23])[CH2:29]4)[s:13][c:14]2[CH2:15][CH2:16][O:17]3)[cH:5]1

Participants

3

Reactant 2

HCID 660572-MethylpiperazineHCID 582038838-(1H-Pyrazol-4-yl)-4,5-dihydro-6-oxa-3-thia-1-aza-benzo[e]azulene-2-carboxylic acid

Product 1

HCID 58204001(3-Methyl-piperazin-1-yl)-[8-(1H-pyrazol-4-yl)-4,5-dihydro-6-oxa-3-thia-1-aza-benzo[e]azulen-2-yl]-methanone

Sources & evidence

ORD record
ord-a38340ebadec490793c1974fe367fcd4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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