Chloride → 6-Amino-1-(3-cyclopentyloxy-4-methoxy-benzyl)-5-(2-(4-methoxybenzyloxy)-2-methyl-propionylamino)-2-thiouracil

HRID 93259Notes

Reaction equation

HRID 93259 reaction equation
[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][O:8][C:9]([C:10](=[O:11])[Cl:12])([CH3:13])[CH3:14])[cH:15][cH:16]1.[Cl-:42].[NH2:17][c:18]1[c:19](=[O:41])[nH:20][c:21](=[S:40])[n:22]([CH2:25][c:26]2[cH:27][c:28]([O:34][CH:35]3[CH2:36][CH2:37][CH2:38][CH2:39]3)[c:29]([O:32][CH3:33])[cH:30][cH:31]2)[c:23]1[NH2:24]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][O:8][C:9]([C:10](=[O:11])[NH:17][c:18]2[c:19](=[O:41])[nH:20][c:21](=[S:40])[n:22]([CH2:25][c:26]3[cH:27][c:28]([O:34][CH:35]4[CH2:36][CH2:37][CH2:38][CH2:39]4)[c:29]([O:32][CH3:33])[cH:30][cH:31]3)[c:23]2[NH2:24])([CH3:13])[CH3:14])[cH:15][cH:16]1

Participants

5

Reactant 4

HCID 312ChlorideHCID 8028TetrahydrofuranHCID 184734541-(3-Cyclopentyloxy-4-methoxy-benzyl)-5,6-diamino-2-thiouracilHCID 184736132-(4-Methoxybenzyloxy)-2-methyl-propionyl chloride

Product 1

HCID 184735306-Amino-1-(3-cyclopentyloxy-4-methoxy-benzyl)-5-(2-(4-methoxybenzyloxy)-2-methyl-propionylamino)-2-thiouracil

Sources & evidence

ORD record
ord-5ce003d0539e48c18ed307863ef88493
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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