Isopropanol → HCID 67264010, compound

HRID 2141380Notes

Reaction equation

HRID 2141380 reaction equation
[C:41]12([CH2:42][S:43]([OH:44])(=[O:45])=[O:46])[C:47]([CH3:48])([CH3:49])[CH:50]([CH2:51][CH2:52]1)[CH2:53][C:54]2=[O:55].[CH:56]([OH:57])([CH3:58])[CH3:59].[Cl:18][c:19]1[n:20][cH:21][c:22]([Cl:40])[c:23]([NH:25][c:26]2[c:27]([O:38][CH3:39])[cH:28][c:29]([N:32]3[CH2:33][CH2:34][O:35][CH2:36][CH2:37]3)[cH:30][cH:31]2)[n:24]1.[NH2:1][c:2]1[cH:3][c:4]2[c:5]([cH:14][c:15]1[O:16][CH3:17])[NH:6][C:7](=[O:13])[CH2:8][CH2:9][C:10]2([CH3:11])[CH3:12]>>[NH:1]([c:2]1[cH:3][c:4]2[c:5]([cH:14][c:15]1[O:16][CH3:17])[NH:6][C:7](=[O:13])[CH2:8][CH2:9][C:10]2([CH3:11])[CH3:12])[c:19]1[n:20][cH:21][c:22]([Cl:40])[c:23]([NH:25][c:26]2[c:27]([O:38][CH3:39])[cH:28][c:29]([N:32]3[CH2:33][CH2:34][O:35][CH2:36][CH2:37]3)[cH:30][cH:31]2)[n:24]1

Participants

5

Reactant 4

HCID 3776IsopropanolHCID 18462Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 7,7-dimethyl-2-oxo-, (1S)-HCID 67263851HCID 67263851, compoundHCID 86633851(2,5-Dichloropyrimidin-4-yl)-(2-methoxy-4-morpholin-4-yl-phenyl)-amine

Product 1

HCID 67264010HCID 67264010, compound

Sources & evidence

ORD record
ord-5693584e2ce542ceae36b347f3cfa16d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…