Acetonitrile → HCID 20134233, compound

HRID 669361Notes

Reaction equation

HRID 669361 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([NH:19][C:20](=[O:21])[NH2:22])[cH:11][c:12]([C:15]([CH2:16][Br:17])=[O:18])[cH:13][cH:14]1.[CH2:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[NH:30][CH:31]([CH2:32][c:33]1[cH:34][cH:35][c:36]([C:39](=[O:40])[O:41][CH3:42])[cH:37][cH:38]1)[CH3:43].[CH3:44][C:45]#[N:46]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([NH:19][C:20](=[O:21])[NH2:22])[cH:11][c:12]([C:15]([CH2:16][N:30]([CH2:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[CH:31]([CH2:32][c:33]2[cH:34][cH:35][c:36]([C:39](=[O:40])[O:41][CH3:42])[cH:37][cH:38]2)[CH3:43])=[O:18])[cH:13][cH:14]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 19974252HCID 19974252, compoundHCID 20029860HCID 20029860, compound

Product 1

HCID 20134233HCID 20134233, compound

Sources & evidence

ORD record
ord-cd69c7e33dac42138ba827b6502be448
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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