Water → HCID 22664750, compound

HRID 670833Notes

Reaction equation

HRID 670833 reaction equation
[CH2:15]([CH3:16])[N:17]1[CH2:18][CH2:19][NH:20][CH2:21][CH2:22]1.[N+:1]([O-:2])(=[O:3])[c:4]1[c:5]([C:13]#[N:14])[c:6]([N+:10](=[O:11])[O-:12])[cH:7][cH:8][cH:9]1.[O:24]=[CH:25][N:26]([CH3:27])[CH3:28].[OH2:23]>>[N:1]1([c:4]2[c:5]([C:13]#[N:14])[c:6]([N+:10](=[O:11])[O-:12])[cH:7][cH:8][cH:9]2)[CH2:19][CH2:18][N:17]([CH2:15][CH3:16])[CH2:22][CH2:21]1

Participants

5

Reactant 4

HCID 962WaterHCID 6228DimethylformamideHCID 791961-EthylpiperazineHCID 520718Dinitrobenzonitrile

Product 1

HCID 22664750HCID 22664750, compound

Sources & evidence

ORD record
ord-ef540c1789174a27b0a7172f213cc636
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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