Dichloromethane → 2,3-Dichloro-5-(N-{1-[N-(1,1-dimethylethoxy)carbonylamino]indan-2-yl}carbamoyl)-4H-thieno[3,2-b]pyrrole

HRID 675472Notes

Reaction equation

HRID 675472 reaction equation
[C:1](=[O:2])([OH:3])[c:4]1[cH:5][c:6]2[c:7]([nH:8]1)[c:9]([Cl:13])[c:10]([Cl:12])[s:11]2.[CH3:51][CH2:52][N:53]=[C:54]=[N:55][CH2:56][CH2:57][CH2:58][N:59]([CH3:60])[CH3:61].[CH:32]([N:33]([CH2:34][CH3:35])[CH:36]([CH3:37])[CH3:38])([CH3:39])[CH3:40].[Cl:62][CH2:63][Cl:64].[NH2:14][CH:15]1[CH:16]([NH:24][C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]2[CH2:23]1.[OH:41][n:42]1[c:43]2[c:44]([cH:45][cH:46][cH:47][cH:48]2)[n:49][n:50]1>>[C:1](=[O:3])([c:4]1[cH:5][c:6]2[c:7]([nH:8]1)[c:9]([Cl:13])[c:10]([Cl:12])[s:11]2)[NH:14][CH:15]1[CH:16]([NH:24][C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]2[CH2:23]1

Participants

7

Reactant 6

HCID 6344DichloromethaneHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 100143182,3-dichloro-4H-thieno[3,2-b]pyrrole-5-carboxylic acidHCID 21920444Tert-butyl N-(2-amino-2,3-dihydro-1H-inden-1-YL)carbamate

Product 1

HCID 219204232,3-Dichloro-5-(N-{1-[N-(1,1-dimethylethoxy)carbonylamino]indan-2-yl}carbamoyl)-4H-thieno[3,2-b]pyrrole

Sources & evidence

ORD record
ord-6f0fa734fd194678b7aef9e3f49b4fe9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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