Water → HCID 22176563, compound

HRID 666049Notes

Reaction equation

HRID 666049 reaction equation
[C:1]([CH2:2][CH2:3][CH3:4])(=[O:5])[Cl:6].[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[NH2:7][c:8]1[cH:9][c:10](-[c:14]2[cH:15][cH:16][c:17]([C:20]([CH2:21][NH:22][S:23](=[O:24])(=[O:25])[CH:26]([CH3:27])[CH3:28])([CH3:29])[F:30])[cH:18][cH:19]2)[cH:11][cH:12][cH:13]1.[OH2:38]>>[C:1]([CH2:2][CH2:3][CH3:4])(=[O:5])[NH:7][c:8]1[cH:9][c:10](-[c:14]2[cH:15][cH:16][c:17]([C:20]([CH2:21][NH:22][S:23](=[O:24])(=[O:25])[CH:26]([CH3:27])[CH3:28])([CH3:29])[F:30])[cH:18][cH:19]2)[cH:11][cH:12][cH:13]1

Participants

6

Reactant 5

HCID 962WaterHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 8855Butyryl chlorideHCID 9863239{2-[4-(3-Aminophenyl)phenyl]-2-fluoropropyl}[(methylethyl)sulfonyl]amine

Product 1

HCID 22176563HCID 22176563, compound

Sources & evidence

ORD record
ord-2f887bc94642441daeb5d64b37ead675
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…