Hydrochloric Acid → HCID 178462532, compound

HRID 1239899Notes

Reaction equation

HRID 1239899 reaction equation
[CH2:1]([CH3:2])[n:3]1[c:4]([CH2:14][CH2:15][CH:16]2[N:17]([C:21]([CH2:22][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)=[O:29])[CH2:18][CH2:19][CH2:20]2)[cH:5][c:6]2[cH:7][cH:8][c:9]([C:12]#[N:13])[cH:10][c:11]12.[CH3:40][OH:41].[ClH:30].[NH2:31][OH:32].[Na+:33].[Na+:34].[O-:35][C:36](=[O:37])[O-:38].[OH2:39]>>[CH2:1]([CH3:2])[n:3]1[c:4]([CH2:14][CH2:15][CH:16]2[N:17]([C:21]([CH2:22][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)=[O:29])[CH2:18][CH2:19][CH2:20]2)[cH:5][c:6]2[cH:7][cH:8][c:9]([CH2:12][N:13]=[N:31][OH:32])[cH:10][c:11]12

Participants

8

Sources & evidence

ORD record
ord-3901ea5b4b2142a8af1dedfa3f52343a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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