Water → Ranisen

HRID 699802Notes

Reaction equation

HRID 699802 reaction equation
[CH3:10][N:11]([CH3:12])[CH2:13][c:14]1[cH:15][cH:16][c:17]([CH2:19][S:20][CH2:21][CH2:22][NH2:23])[o:18]1.[CH3:1][NH:2][C:3](=[CH:4][N+:5](=[O:6])[O-:7])[S:8][CH3:9].[CH3:24][CH:25]([CH3:26])[CH2:27][C:28](=[O:29])[CH3:30].[OH2:31]>>[CH3:1][NH:2][C:3](=[CH:4][N+:5](=[O:6])[O-:7])[NH:23][CH2:22][CH2:21][S:20][CH2:19][c:17]1[cH:16][cH:15][c:14]([CH2:13][N:11]([CH3:10])[CH3:12])[o:18]1

Participants

5

Reactant 4

HCID 962WaterHCID 7909Methyl Isobutyl KetoneHCID 1235491-Methylthio-1-methylamino-2-nitroethyleneHCID 1622035-(((2-Aminoethyl)thio)methyl)-N,N-dimethyl-2-furanmethanamine

Product 1

HCID 5039Ranisen

Sources & evidence

ORD record
ord-414e0acd5cfb4f0bbf524f29535e3899
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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