Hydrochloric Acid → Hydrochloric Acid

HRID 282562Notes

Reaction equation

HRID 282562 reaction equation
[CH3:21][CH2:22][N:23]([CH2:24][CH3:25])[CH2:26][CH3:27].[CH3:38][OH:39].[ClH:1].[ClH:2].[ClH:3].[NH2:28][c:29]1[c:30]([O:35][CH2:36][CH3:37])[c:31](=[O:34])[c:32]1=[O:33].[NH2:4][CH2:5][c:6]1[cH:7][cH:8][cH:9][c:10](-[c:12]2[n:13][c:14]([N:17]=[C:18]([NH2:19])[NH2:20])[s:15][cH:16]2)[n:11]1>>[ClH:1].[NH:4]([CH2:5][c:6]1[cH:7][cH:8][cH:9][c:10](-[c:12]2[n:13][c:14]([N:17]=[C:18]([NH2:19])[NH2:20])[s:15][cH:16]2)[n:11]1)[c:30]1[c:29]([NH2:28])[c:32](=[O:33])[c:31]1=[O:34]

Participants

7

Reactant 5

HCID 313Hydrochloric Acid3×HCID 887MethanolHCID 8471TriethylamineHCID 103997684-(6-Aminomethylpyridin-2-yl)-2-(diaminomethyleneamino)thiazoleHCID 151463363-Amino-4-ethoxycyclobut-3-ene-1,2-dione

Product 2

HCID 313Hydrochloric AcidHCID 189538952-[4-[6-[[(2-Amino-3,4-dioxocyclobuten-1-yl)amino]methyl]-2-pyridinyl]-1,3-thiazol-2-yl]guanidine

Sources & evidence

ORD record
ord-9bfb226335d040839a792c16788a2420
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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