Water → HCID 178430685, compound

HRID 2326596Notes

Reaction equation

HRID 2326596 reaction equation
[C:1]12([CH2:11][NH:12][C:13](=[O:14])[c:15]3[cH:16][cH:17][cH:18][c:19]4[n:20]3[cH:21][c:22]([CH2:24][C:25](=[O:26])[OH:27])[n:23]4)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2.[CH3:28][CH:29]1[NH:30][CH2:31][CH2:32][NH:33][CH2:34]1.[CH3:40][CH2:41][O:42][C:43]([CH3:44])=[O:45].[O:35]=[CH:36][N:37]([CH3:38])[CH3:39].[OH2:46]>>[C:1]12([CH2:11][NH:12][C:13](=[O:14])[c:15]3[cH:16][cH:17][cH:18][c:19]4[n:20]3[cH:21][c:22]([CH2:24][C:25](=[O:26])[N:33]3[CH2:32][CH2:31][NH:30][CH:29]([CH3:28])[CH2:34]3)[n:23]4)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 660572-MethylpiperazineHCID 25270079HCID 25270079, compound

Product 1

HCID 178430685HCID 178430685, compound

Sources & evidence

ORD record
ord-4a1e0362c51b4c708508dee3c8ff27ef
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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