Sodium ion → HCID 86649623, compound

HRID 675173Notes

Reaction equation

HRID 675173 reaction equation
[C:77](=[O:78])([O-:79])[O-:80].[CH3:29][C:30]1([CH3:31])[c:32]2[cH:33][cH:34][cH:35][c:36]([P:37]([c:38]3[cH:39][cH:40][cH:41][cH:42][cH:43]3)[c:44]3[cH:45][cH:46][cH:47][cH:48][cH:49]3)[c:50]2[O:51][c:52]2[c:53]1[cH:54][cH:55][cH:56][c:57]2[P:58]([c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1)[c:65]1[cH:66][cH:67][cH:68][cH:69][cH:70]1.[CH3:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1.[CH:83]([Cl:84])([Cl:85])[Cl:86].[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]([CH2:8][C:9]2([OH:22])[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:13][CH2:14]2)[n:7]1.[Cs+:81].[Cs+:82].[NH2:23][c:24]1[s:25][cH:26][cH:27][n:28]1.[Na+:71].[Na+:72].[O-:73][C:74](=[O:75])[O-:76]>>[c:2]1([NH:23][c:24]2[s:25][cH:26][cH:27][n:28]2)[cH:3][cH:4][cH:5][c:6]([CH2:8][C:9]2([OH:22])[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:13][CH2:14]2)[n:7]1

Participants

9

Reactant 8

HCID 923Sodium ion2×HCID 1140TolueneHCID 21552-AminothiazoleHCID 6212ChloroformHCID 19660Carbonate Ion2×HCID 104967Cesium cation2×HCID 6360441,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)HCID 57366393HCID 57366393, compound

Product 1

HCID 86649623HCID 86649623, compound

Sources & evidence

ORD record
ord-786ff7a9484548b3a2c25beff45437e3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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