Hydrochloric Acid → HCID 178492138, compound

HRID 1152847Notes

Reaction equation

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

Participants

Reactant 6

HCID 313Hydrochloric Acid

HCID 962Water

HCID 13387N-methyl-2-pyrrolidone

HCID 81531Diisopropylethylamine

HCID 2208783-amino-2-methylbutan-2-ol

HCID 219952032-Chloro-N-(4-methoxyphenyl)pyrimidin-4-amine

Product 1

HCID 178492138HCID 178492138, compound

Sources & evidence

ORD record: ord-09eedc1109974209a505493e35de48cf
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…