Sulfuric Acid → N2-(4-(4-chloro-1H-imidazol-1-yl)-3-methoxyphenyl)-N4-cyclopropyl-7-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine

HRID 283102Notes

Reaction equation

HRID 283102 reaction equation
[CH3:41][CH2:42][O:43][C:44]([CH3:45])=[O:46].[CH3:47][N:48]1[CH2:49][CH2:50][CH2:51][C:52]1=[O:53].[Cl:1][c:2]1[n:3][c:4]([NH:17][CH:18]2[CH2:19][CH2:20]2)[c:5]2[c:6]([n:7]1)[CH:8]([c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[CH2:9][CH2:10]2.[Cl:21][c:22]1[n:23][cH:24][n:25](-[c:27]2[c:28]([O:34][CH3:35])[cH:29][c:30]([NH2:31])[cH:32][cH:33]2)[cH:26]1.[S:36](=[O:37])(=[O:38])([OH:39])[OH:40]>>[c:2]1([NH:31][c:30]2[cH:29][c:28]([O:34][CH3:35])[c:27](-[n:25]3[cH:24][n:23][c:22]([Cl:21])[cH:26]3)[cH:33][cH:32]2)[n:3][c:4]([NH:17][CH:18]2[CH2:19][CH2:20]2)[c:5]2[c:6]([n:7]1)[CH:8]([c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[CH2:9][CH2:10]2

Participants

6

Reactant 5

HCID 1118Sulfuric AcidHCID 8857Ethyl AcetateHCID 13387N-methyl-2-pyrrolidoneHCID 580757574-(4-chloro-1H-imidazol-1-yl)-3-methoxyanilineHCID 580758182-chloro-N-cyclopropyl-7-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

Product 1

HCID 50913638N2-(4-(4-chloro-1H-imidazol-1-yl)-3-methoxyphenyl)-N4-cyclopropyl-7-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine

Sources & evidence

ORD record
ord-1420bc710b1648d5967b84eecc6b03b7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…