Methanol → HCID 57863446, compound

HRID 1145571Notes

Reaction equation

HRID 1145571 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([P:7]2(=[S:10])[S:8][P:9]([c:11]3[cH:12][cH:13][c:14]([O:15][CH3:16])[cH:17][cH:18]3)(=[S:19])[S:20]2)[cH:21][cH:22]1.[CH3:58][OH:59].[CH3:60][N:61]([P:62]([N:63]([CH3:64])[CH3:65])([N:66]([CH3:67])[CH3:68])=[O:69])[CH3:70].[n:23]1[cH:24][cH:25][c:26](-[c:29]2[cH:30][c:31]3[n:32]([cH:33][cH:34]2)[c:35](-[c:38]2[cH:39][cH:40][c:41]([CH2:44][C:45](=[O:46])[NH:47][c:48]4[cH:49][c:50]([C:54]([F:55])([F:56])[F:57])[cH:51][cH:52][cH:53]4)[cH:42][cH:43]2)[cH:36][n:37]3)[cH:27][cH:28]1>>[S:10]=[C:45]([CH2:44][c:41]1[cH:40][cH:39][c:38](-[c:35]2[n:32]3[c:31]([cH:30][c:29](-[c:26]4[cH:25][cH:24][n:23][cH:28][cH:27]4)[cH:34][cH:33]3)[n:37][cH:36]2)[cH:43][cH:42]1)[NH:47][c:48]1[cH:49][c:50]([C:54]([F:55])([F:56])[F:57])[cH:51][cH:52][cH:53]1

Participants

5

Sources & evidence

ORD record
ord-c097faaf205848c2bc2a9da74d8c680d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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