Hydrochloric Acid → [(6-Cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)amino]urea

HRID 86233

Reaction equation

HRID 86233 reaction equation
[C:7](#[N:8])[c:9]1[cH:10][cH:11][c:12]2[c:13]([cH:21]1)[CH:14]1[CH:15]([C:16]([CH3:18])([CH3:19])[O:17]2)[O:20]1.[CH3:22][CH2:23][N:24]([CH2:25][CH3:26])[CH2:27][CH3:28].[ClH:1].[NH2:2][NH:3][C:4](=[O:5])[NH2:6]>>[NH:2]([NH:3][C:4](=[O:5])[NH2:6])[CH:14]1[c:13]2[c:12]([cH:11][cH:10][c:9]([C:7]#[N:8])[cH:21]2)[O:17][C:16]([CH3:18])([CH3:19])[CH:15]1[OH:20]

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 5196SemicarbazideHCID 8471TriethylamineHCID 108673602,2-Dimethyl-3,4-epoxy-6-cyanochroman

Product 1

HCID 19021549[(6-Cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)amino]urea

Sources & evidence

ORD record
ord-d7f908d66de7467a834743e5ad1a097b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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