Diethylamine → N,N-diethyl-N'-[4-(1-ethyl-4-{2-[4-(1-pyrrolidinylmethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-4-yl}-1H-pyrazol-3-yl)phenyl]urea

HRID 136084Notes

Reaction equation

HRID 136084 reaction equation
[CH2:1]([CH3:2])[n:3]1[n:4][c:5](-[c:29]2[cH:30][cH:31][c:32]([NH2:33])[cH:34][cH:35]2)[c:6](-[c:8]2[c:9]3[c:10]([n:11][cH:12][cH:13]2)[nH:14][c:15](-[c:17]2[cH:18][cH:19][c:20]([CH2:23][N:24]4[CH2:25][CH2:26][CH2:27][CH2:28]4)[cH:21][cH:22]2)[cH:16]3)[cH:7]1.[CH2:49]([CH3:50])[NH:51][CH2:52][CH3:53].[CH2:54]1[O:55][CH2:56][CH2:57][CH2:58]1.[Cl:36][C:37](=[O:38])[O:39][c:40]1[cH:41][cH:42][c:43]([N+:44]([O-:45])=[O:46])[cH:47][cH:48]1>>[CH2:1]([CH3:2])[n:3]1[n:4][c:5](-[c:29]2[cH:30][cH:31][c:32]([NH:33][C:37](=[O:38])[N:51]([CH2:49][CH3:50])[CH2:52][CH3:53])[cH:34][cH:35]2)[c:6](-[c:8]2[c:9]3[c:10]([n:11][cH:12][cH:13]2)[nH:14][c:15](-[c:17]2[cH:18][cH:19][c:20]([CH2:23][N:24]4[CH2:25][CH2:26][CH2:27][CH2:28]4)[cH:21][cH:22]2)[cH:16]3)[cH:7]1

Participants

5

Reactant 4

HCID 8021DiethylamineHCID 8028TetrahydrofuranHCID 821294-Nitrophenyl chloroformateHCID 68995250HCID 68995250, compound

Product 1

HCID 24816135N,N-diethyl-N'-[4-(1-ethyl-4-{2-[4-(1-pyrrolidinylmethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-4-yl}-1H-pyrazol-3-yl)phenyl]urea

Sources & evidence

ORD record
ord-b2ac15a3a193444a926b7dec662b9865
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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