Ethanol → HCID 15859133, compound

HRID 214273Notes

Reaction equation

HRID 214273 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]1.[CH3:38][CH2:39][OH:40].[CH:28]([N:29]([CH:30]([CH3:31])[CH3:32])[CH2:33][CH3:34])([CH3:35])[CH3:36].[Cl:14][CH2:15][CH2:16][CH2:17][n:18]1[c:19](=[O:27])[nH:20][c:21]2[c:22]1[cH:23][cH:24][cH:25][cH:26]2.[OH2:37]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([CH2:15][CH2:16][CH2:17][n:18]2[c:19](=[O:27])[nH:20][c:21]3[c:22]2[cH:23][cH:24][cH:25][cH:26]3)[CH2:12][CH2:13]1

Participants

6

Reactant 5

HCID 702EthanolHCID 962WaterHCID 81531DiisopropylethylamineHCID 143452tert-Butyl piperazine-1-carboxylateHCID 18104191-(3-chloropropyl)-1,3-dihydro-2H-benzimidazol-2-one

Product 1

HCID 15859133HCID 15859133, compound

Sources & evidence

ORD record
ord-ef87cdb50b5543ef8585c6ff20e08772
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…