Tetrahydrofuran → HCID 66640745, compound

HRID 1136074Notes

Reaction equation

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

Participants

Reactant 3

HCID 8028Tetrahydrofuran

HCID 52232135-Isocyanato-1,3-dioxaindane

HCID 66641143Tert-butyl 2-amino-3-{5-ethyl-6-[4-(5,6,7,8-tetrahydro-[1,8]naphthyridin-2-yl)-piperidin-1-yl]-pyrimidin-4-ylamino}-propionate

Product 1

HCID 66640745HCID 66640745, compound

Sources & evidence

ORD record: ord-46184143900343a189a947cbcd57ba68
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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