Methanethiol → Ethyl 6-methyl-4-(2-methylthio-5-nitrophenyl)-2-phenyl-5-pyrimidinecarboxylate

HRID 1123478Notes

Reaction equation

HRID 1123478 reaction equation
[CH3:29][SH:30].[Cl:1][c:2]1[c:3](-[c:11]2[n:12][c:13](-[c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[n:14][c:15]([CH3:22])[c:16]2[C:17](=[O:18])[O:19][CH2:20][CH3:21])[cH:4][c:5]([N+:8](=[O:9])[O-:10])[cH:6][cH:7]1.[Na:31].[O:32]1[CH2:33][CH2:34][CH2:35][CH2:36]1>>[c:2]1([S:30][CH3:29])[c:3](-[c:11]2[n:12][c:13](-[c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[n:14][c:15]([CH3:22])[c:16]2[C:17](=[O:18])[O:19][CH2:20][CH3:21])[cH:4][c:5]([N+:8](=[O:9])[O-:10])[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 878MethanethiolHCID 8028TetrahydrofuranHCID 5360545SodiumHCID 15147503Ethyl 4-(2-chloro-5-nitrophenyl)-6-methyl-2-phenyl-5-pyrimidinecarboxylate

Product 1

HCID 15147504Ethyl 6-methyl-4-(2-methylthio-5-nitrophenyl)-2-phenyl-5-pyrimidinecarboxylate

Sources & evidence

ORD record
ord-4d72669c2c4447729798749783ae9012
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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