2-Bromo-4'-nitroacetophenone → Methyl 4-(4-(4-nitrophenyl)(1,3-thiazol-2-yl))-5-methylthiothiophene-2-carboxylate

HRID 1549678Notes

Reaction equation

HRID 1549678 reaction equation
[Br:37][CH2:38][C:39]([c:40]1[cH:41][cH:42][c:43]([N+:44]([O-:45])=[O:46])[cH:47][cH:48]1)=[O:49].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7](-[c:10]2[n:11][c:12](-[c:15]3[cH:16][c:17]([C:21](=[S:22])[O-:23])[s:18][c:19]3[CH3:20])[s:13][cH:14]2)[cH:8][cH:9]1.[NH2:24][C:25](=[S:26])[c:27]1[cH:28][c:29]([C:30]([O:31][CH3:32])=[S:33])[s:34][c:35]1[CH3:36]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7](-[c:10]2[n:11][c:12](-[c:15]3[cH:16][c:17]([C:21](=[S:22])[O:23][CH3:25])[s:18][c:19]3[CH3:20])[s:13][cH:14]2)[cH:8][cH:9]1

Participants

4

Reactant 3

HCID 668402-Bromo-4'-nitroacetophenoneHCID 86583815Methyl 4-(aminothioxomethyl)-5-methylthiothiophene-2-carboxylateHCID 1784350885-methyl-4-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]thiophene-2-carbothioate

Product 1

HCID 86758673Methyl 4-(4-(4-nitrophenyl)(1,3-thiazol-2-yl))-5-methylthiothiophene-2-carboxylate

Sources & evidence

ORD record
ord-08b00e48bf9b4023be5b0976c7baeee1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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