Water → HCID 66967677, compound

HRID 1559801Notes

Reaction equation

HRID 1559801 reaction equation
[CH3:49][N:50]([CH3:51])[CH2:52][CH2:53][CH2:54][N:55]=[C:56]=[N:57][CH2:58][CH3:59].[CH:40]([N:41]([CH:42]([CH3:43])[CH3:44])[CH2:45][CH3:46])([CH3:47])[CH3:48].[Cl:1][c:2]1[c:3]([CH2:11][NH:12][CH3:13])[o:4][c:5]2[c:6]1[cH:7][cH:8][cH:9][cH:10]2.[O:14]=[C:15]1[NH:16][c:17]2[c:18]([cH:21][c:22]([CH:25]=[CH:26][C:27](=[O:28])[OH:29])[cH:23][n:24]2)[O:19][CH2:20]1.[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[OH2:65].[OH:30][n:31]1[c:32]2[cH:33][cH:34][cH:35][cH:36][c:37]2[n:38][n:39]1>>[Cl:1][c:2]1[c:3]([CH2:11][N:12]([CH3:13])[C:27]([CH:26]=[CH:25][c:22]2[cH:21][c:18]3[c:17]([n:24][cH:23]2)[NH:16][C:15](=[O:14])[CH2:20][O:19]3)=[O:29])[o:4][c:5]2[c:6]1[cH:7][cH:8][cH:9][cH:10]2

Participants

8

Reactant 7

HCID 962WaterHCID 6228DimethylformamideHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 59277587(3-Chloro-benzofuran-2-ylmethyl)methylamineHCID 669670993-(3-Oxo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazin-7-yl)-acrylic acid

Product 1

HCID 66967677HCID 66967677, compound

Sources & evidence

ORD record
ord-d8d0c9617b2d4a38af5d10d41e7fb90b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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