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

HRID 2340247Notes

Reaction equation

HRID 2340247 reaction equation
[CH3:42][CH2:43][O:44][C:45]([CH3:46])=[O:47].[CH3:48][N:49]1[CH2:50][CH2:51][CH2:52][C:53]1=[O:54].[Cl:1][c:2]1[n:3][c:4]([NH:17][CH:18]2[CH2:19][CH2:20][CH2:21]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:22][c:23]1[n:24][cH:25][n:26](-[c:28]2[c:29]([O:35][CH3:36])[cH:30][c:31]([NH2:32])[cH:33][cH:34]2)[cH:27]1.[S:37](=[O:38])(=[O:39])([OH:40])[OH:41]>>[c:2]1([NH:32][c:31]2[cH:30][c:29]([O:35][CH3:36])[c:28](-[n:26]3[cH:25][n:24][c:23]([Cl:22])[cH:27]3)[cH:34][cH:33]2)[n:3][c:4]([NH:17][CH:18]2[CH2:19][CH2:20][CH2:21]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 580753022-chloro-N-cyclobutyl-7-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amineHCID 580757574-(4-chloro-1H-imidazol-1-yl)-3-methoxyaniline

Product 1

HCID 50913785N2-(4-(4-chloro-1H-imidazol-1-yl)-3-methoxyphenyl)-N4-cyclobutyl-7-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine

Sources & evidence

ORD record
ord-d9d03fd9d9f4449ea8b8d748f8937727
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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