Methanol → 6-methyl-4-(3-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid

HRID 1553978Notes

Reaction equation

[CH3:1][C:2]1=[C:7]([C:8](=[O:9])[OH:10])[CH:6]([c:11]2[cH:12][c:13]([N+:17](=[O:18])[O-:19])[cH:14][cH:15][cH:16]2)[N:5]([C:20]([OH:21])=[O:22])[C:4](=[S:23])[NH:3]1.[CH3:24][OH:25].[CH3:26][O-:27].[Na+:28]>>[CH3:1][C:2]1=[C:7]([C:8](=[O:9])[OH:10])[CH:6]([c:11]2[cH:12][c:13]([N+:17](=[O:18])[O-:19])[cH:14][cH:15][cH:16]2)[NH:5][C:4](=[S:23])[NH:3]1

Participants

Reactant 4

HCID 887Methanol

HCID 923Sodium ion

HCID 3826051Methoxide

HCID 197695663,6-dihydro-4-methyl-6-(3-nitrophenyl)-2-thioxo-1,5(2H)-pyrimidinedicarboxylic acid

Product 1

HCID 197695816-methyl-4-(3-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid

Sources & evidence

ORD record: ord-82cac12efb5b4b1dae220af58569ca2a
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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