1,2-Dichloroethane → 2-ethyl-6-methyl-isonicotinic acid N'-(1,1,2-trimethyl-1,1a,5,5a-tetrahydro-3-thia-cyclopropa[a]pentalene-4-carbonyl)-hydrazide

HRID 288540Notes

Reaction equation

HRID 288540 reaction equation
[CH2:1]([CH3:2])[c:3]1[cH:4][c:5]([C:6](=[O:7])[OH:8])[cH:9][c:10]([CH3:12])[n:11]1.[CH2:39]([Cl:40])[CH2:41][Cl:42].[CH3:13][C:14]1([CH3:28])[CH:15]2[CH:16]1[CH2:17][c:18]1[c:19]([C:24](=[O:25])[NH:26][NH2:27])[s:20][c:21]([CH3:23])[c:22]12.[Cl:43][CH2:44][Cl:45].[OH:29][n:30]1[c:31]2[c:32]([cH:33][cH:34][cH:35][cH:36]2)[n:37][n:38]1>>[CH2:1]([CH3:2])[c:3]1[cH:4][c:5]([C:6](=[O:8])[NH:27][NH:26][C:24]([c:19]2[c:18]3[c:22]([c:21]([CH3:23])[s:20]2)[CH:15]2[C:14]([CH3:13])([CH3:28])[CH:16]2[CH2:17]3)=[O:25])[cH:9][c:10]([CH3:12])[n:11]1

Participants

6

Reactant 5

HCID 111,2-DichloroethaneHCID 6344DichloromethaneHCID 757711-HydroxybenzotriazoleHCID 584180972-Ethyl-6-methylisonicotinic acidHCID 675205611,1,2-Trimethyl-1,1a,5,5a-tetrahydro-3-thia-cyclopropa[a]pentalene-4-carboxylic acid hydrazide

Product 1

HCID 675205712-ethyl-6-methyl-isonicotinic acid N'-(1,1,2-trimethyl-1,1a,5,5a-tetrahydro-3-thia-cyclopropa[a]pentalene-4-carbonyl)-hydrazide

Sources & evidence

ORD record
ord-435bb35556ab4dc98b3de88719446aa4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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