Hydrochloric Acid → HCID 12004070, compound

HRID 666782Notes

Reaction equation

HRID 666782 reaction equation
[C:35](=[O:36])([OH:37])[O-:38].[CH3:40][C:41]#[N:42].[Cl:1][c:2]1[c:3]([N:8]2[CH2:9][c:10]3[n:11][cH:12][n:13][c:14]([NH:18][c:19]4[cH:20][cH:21][c:22]5[c:27]([cH:28]4)[N:26]([C:29](=[O:30])[CH3:31])[CH2:25][CH2:24][C:23]5([CH3:32])[CH3:33])[c:15]3[CH2:16][CH2:17]2)[n:4][cH:5][cH:6][cH:7]1.[ClH:34].[Na+:39]>>[Cl:1][c:2]1[c:3]([N:8]2[CH2:9][c:10]3[n:11][cH:12][n:13][c:14]([NH:18][c:19]4[cH:20][cH:21][c:22]5[c:27]([cH:28]4)[NH:26][CH2:25][CH2:24][C:23]5([CH3:32])[CH3:33])[c:15]3[CH2:16][CH2:17]2)[n:4][cH:5][cH:6][cH:7]1

Participants

6

Sources & evidence

ORD record
ord-a92bb6a259b44bedadc20e7fa2633b14
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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