Tetrahydrofuran → HCID 66757630, compound

HRID 2334031Notes

Reaction equation

HRID 2334031 reaction equation
[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH:43]([CH3:44])([CH3:45])[N:46]=[C:47]=[O:48].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([OH:35])[C:9]([CH3:33])([CH3:34])[CH2:10][N:11]([CH2:14][CH2:15][CH:16]=[C:17]3[c:18]4[c:19]([cH:28][cH:29][c:30]([OH:32])[cH:31]4)[O:20][CH2:21][c:22]4[c:23]3[cH:24][cH:25][cH:26][n:27]4)[CH2:12][CH2:13]2)[cH:6][cH:7]1.[O:49]1[CH2:50][CH2:51][CH2:52][CH2:53]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([OH:35])[C:9]([CH3:33])([CH3:34])[CH2:10][N:11]([CH2:14][CH2:15][CH:16]=[C:17]3[c:18]4[c:19]([cH:28][cH:29][c:30]([O:32][C:47]([NH:46][CH:43]([CH3:44])[CH3:45])=[O:48])[cH:31]4)[O:20][CH2:21][c:22]4[c:23]3[cH:24][cH:25][cH:26][n:27]4)[CH2:12][CH2:13]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 61277Isopropyl isocyanateHCID 66757704HCID 66757704, compound

Product 1

HCID 66757630HCID 66757630, compound

Sources & evidence

ORD record
ord-9e8101573dcc4bf39ee0e67221ffecfc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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