Diisopropyl Ether → Ethyl 4-[[[2-nitrophenyl)-amino]thioxomethyl(phenylmethyl)amino]-1-piperidinecarboxylate

HRID 158547Notes

Reaction equation

HRID 158547 reaction equation
[N:20](=[C:21]=[S:22])[c:23]1[c:24]([N+:29](=[O:30])[O-:31])[cH:25][cH:26][cH:27][cH:28]1.[O:32]([CH:33]([CH3:34])[CH3:35])[CH:36]([CH3:37])[CH3:38].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[c:1]1([CH2:7][NH:8][CH:9]2[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH2:18][CH3:19])[CH2:13][CH2:14]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][N:8]([CH:9]2[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH2:18][CH3:19])[CH2:13][CH2:14]2)[C:21]([NH:20][c:23]2[c:24]([N+:29](=[O:30])[O-:31])[cH:25][cH:26][cH:27][cH:28]2)=[S:22])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 7914Diisopropyl EtherHCID 8028TetrahydrofuranHCID 1376902-Nitrophenyl isothiocyanateHCID 13587975Ethyl 4-[(phenylmethyl)amino]-1-piperidinecarboxylate

Product 1

HCID 13587976Ethyl 4-[[[2-nitrophenyl)-amino]thioxomethyl(phenylmethyl)amino]-1-piperidinecarboxylate

Sources & evidence

ORD record
ord-cbf24dac6d5c49c599d9538f5f7ae32b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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