Diisopropylamine → HCID 91530092, compound

HRID 124780Notes

Reaction equation

HRID 124780 reaction equation
[CH3:35][N:36]([CH3:37])[CH2:38][C:39]#[CH:40].[CH:1]1([S:4][c:5]2[cH:6][cH:7][c:8]([C:11](=[CH:12][CH2:13][O:14][c:15]3[cH:16][c:17]([CH3:27])[c:18]([O:19][CH2:20][C:21](=[O:22])[O:23][CH3:24])[cH:25][cH:26]3)[c:28]3[cH:29][cH:30][c:31]([I:34])[cH:32][cH:33]3)[cH:9][cH:10]2)[CH2:2][CH2:3]1.[CH:41]([NH:42][CH:43]([CH3:44])[CH3:45])([CH3:46])[CH3:47].[Cu:94][I:95].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1.[Pd:53]([Cl:54])[Cl:55].[c:56]1([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[cH:70][cH:71][cH:72][cH:73][cH:74]1.[c:75]1([P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[cH:89][cH:90][cH:91][cH:92][cH:93]1>>[CH:1]1([S:4][c:5]2[cH:6][cH:7][c:8]([C:11](=[CH:12][CH2:13][O:14][c:15]3[cH:16][c:17]([CH3:27])[c:18]([O:19][CH2:20][C:21](=[O:22])[O:23][CH3:24])[cH:25][cH:26]3)[c:28]3[cH:29][cH:30][c:31]([C:40]#[C:39][CH2:38][N:36]([CH3:35])[CH3:37])[cH:32][cH:33]3)[cH:9][cH:10]2)[CH2:2][CH2:3]1

Participants

8

Reactant 7

HCID 7912DiisopropylamineHCID 8028TetrahydrofuranHCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 81643N,N-DimethylpropargylamineHCID 90934387HCID 90934387, compound

Product 1

HCID 91530092HCID 91530092, compound

Sources & evidence

ORD record
ord-c3cd30ac6c8d4babae81636416505d4d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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