Acetic Acid → N2-(4-(3-chloro-1H-1,2,4-triazol-1-yl)-3-methoxyphenyl)-N4-methyl-7-(3,4,5-trifluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine

HRID 2162759Notes

Reaction equation

HRID 2162759 reaction equation
[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:37][C:38](=[O:39])[OH:40].[Cl:1][c:2]1[n:3][c:4]([NH:20][CH3:21])[c:5]2[c:6]([n:7]1)[CH:8]([c:11]1[cH:12][c:13]([F:19])[c:14]([F:18])[c:15]([F:17])[cH:16]1)[CH2:9][CH2:10]2.[Cl:22][c:23]1[n:24][n:25](-[c:28]2[c:29]([O:35][CH3:36])[cH:30][c:31]([NH2:32])[cH:33][cH:34]2)[cH:26][n:27]1>>[c:2]1([NH:32][c:31]2[cH:30][c:29]([O:35][CH3:36])[c:28](-[n:25]3[n:24][c:23]([Cl:22])[n:27][cH:26]3)[cH:34][cH:33]2)[n:3][c:4]([NH:20][CH3:21])[c:5]2[c:6]([n:7]1)[CH:8]([c:11]1[cH:12][c:13]([F:19])[c:14]([F:18])[c:15]([F:17])[cH:16]1)[CH2:9][CH2:10]2

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 8028TetrahydrofuranHCID 58075503HCID 58075503, compoundHCID 580756192-chloro-N-methyl-7-(3,4,5-trifluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

Product 1

HCID 58075722N2-(4-(3-chloro-1H-1,2,4-triazol-1-yl)-3-methoxyphenyl)-N4-methyl-7-(3,4,5-trifluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine

Sources & evidence

ORD record
ord-8528dff6f9c345ca93bca5548b5ddc7d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…