Chloride → HCID 54515577, compound

HRID 314791Notes

Reaction equation

HRID 314791 reaction equation
[CH2:29]([NH:30][c:31]1[cH:32][cH:33][c:34]([CH2:35][CH:36]=[O:54])[cH:37][cH:38]1)[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH3:53].[CH2:2]([CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH3:17])[NH:18][c:19]1[cH:20][cH:21][c:22]([CH:23]=[CH:24][C:25]#[N:26])[cH:27][cH:28]1.[CH2:55]([NH:56][c:57]1[cH:58][cH:59][c:60]([CH2:61][CH2:62][CH2:63][CH:64]=[O:65])[cH:66][cH:67]1)[CH2:68][CH2:69][CH2:70][CH2:71][CH2:72][CH2:73][CH2:74][CH2:75][CH2:76][CH2:77][CH2:78][CH2:79][CH2:80][CH2:81][CH3:82].[Cl-:1]>>[CH2:2]([CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH3:17])[NH:18][c:19]1[cH:20][cH:21][c:22]([CH:23]=[CH:24][CH:25]=[O:54])[cH:27][cH:28]1

Participants

5

Reactant 4

HCID 312ChlorideHCID 20525857HCID 20525857, compoundHCID 54090670HCID 54090670, compoundHCID 54551803HCID 54551803, compound

Product 1

HCID 54515577HCID 54515577, compound

Sources & evidence

ORD record
ord-2490cfb5bed04903911a31c669b66edb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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