Water → HCID 58709765, compound

HRID 2340120Notes

Reaction equation

HRID 2340120 reaction equation
[C-:38]#[N:39].[C-:41]#[N:42].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([c:14]2[cH:15][c:16]3[c:17]([n:18][cH:19][c:20]([Br:32])[c:21]3[NH:22][c:23]3[cH:24][c:25]4[cH:26][n:27][nH:28][c:29]4[cH:30][cH:31]3)[nH:33]2)=[CH:12][CH2:13]1.[CH3:35][C:36]#[N:37].[OH2:34].[Zn+2:40]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([c:14]2[cH:15][c:16]3[c:17]([n:18][cH:19][c:20]([C:36]#[N:37])[c:21]3[NH:22][c:23]3[cH:24][c:25]4[cH:26][n:27][nH:28][c:29]4[cH:30][cH:31]3)[nH:33]2)=[CH:12][CH2:13]1

Participants

6

Reactant 5

HCID 962WaterHCID 5975Cyanide2×HCID 6342AcetonitrileHCID 32051Zinc(2+)HCID 59854604HCID 59854604, compound

Product 1

HCID 58709765HCID 58709765, compound

Sources & evidence

ORD record
ord-3035a0d78bcf45c5bf688de51c89ae76
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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