2-Thiophenecarboxylic acid, 3-(chlorosulfonyl)-, methyl ester → HCID 10077689, compound

HRID 700936Notes

Reaction equation

HRID 700936 reaction equation
[CH3:32][O:33][C:34](=[O:35])[c:36]1[s:37][cH:38][cH:39][c:40]1[S:41](=[O:42])(=[O:43])[Cl:44].[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][c:7]2[n:8][c:9]3[n:10]([CH2:26][CH2:27][CH2:28][CH3:29])[c:11](=[O:25])[n:12]([CH2:17][c:18]4[c:19]([F:24])[cH:20][cH:21][cH:22][cH:23]4)[c:13](=[O:16])[c:14]3[nH:15]2)[cH:30][cH:31]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([CH2:6][c:7]2[n:8][c:9]3[n:10]([CH2:26][CH2:27][CH2:28][CH3:29])[c:11](=[O:25])[n:12]([CH2:17][c:18]4[c:19]([F:24])[cH:20][cH:21][cH:22][cH:23]4)[c:13](=[O:16])[c:14]3[nH:15]2)[cH:30][cH:31]1)[S:41]([c:40]1[c:36]([C:34]([O:33][CH3:32])=[O:35])[s:37][cH:38][cH:39]1)(=[O:42])=[O:43]

Participants

3

Reactant 2

HCID 27367332-Thiophenecarboxylic acid, 3-(chlorosulfonyl)-, methyl esterHCID 218917201-(2-fluorobenzyl)-8-(4-aminobenzyl)-3-butyl-1H-purine-2,6(3H,7H)-dione

Product 1

HCID 10077689HCID 10077689, compound

Sources & evidence

ORD record
ord-36ddca4eb5cb4f9188cde49ce155c411
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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