Diethyl Ether → HCID 178485636, compound

HRID 1152839Notes

Reaction equation

HRID 1152839 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][S:8][CH:9]([C:10](=[O:11])[NH:12][C:13]2([CH2:31][CH2:32][c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[C:14](=[O:30])[N:15]([CH:18]([CH2:19][c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[C:26]([NH:27][CH3:28])=[O:29])[CH2:16][CH2:17]2)[CH2:39][CH2:40][CH2:41][CH2:42][NH:43][C:44](=[O:45])[c:46]2[cH:47][cH:48][n:49][cH:50][cH:51]2)[cH:52][cH:53]1.[CH3:54][O:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1.[CH3:62][CH2:63][CH2:64][CH2:65][CH2:66][CH3:67].[CH3:68][CH2:69][O:70][CH2:71][CH3:72].[Cl:73][CH2:74][Cl:75]>>[SH:8][CH:9]([C:10](=[O:11])[NH:12][C:13]1([CH2:31][CH2:32][c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[C:14](=[O:30])[N:15]([CH:18]([CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[C:26]([NH:27][CH3:28])=[O:29])[CH2:16][CH2:17]1)[CH2:39][CH2:40][CH2:41][CH2:42][NH:43][C:44](=[O:45])[c:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1

Participants

6

Reactant 5

HCID 3283Diethyl EtherHCID 6344DichloromethaneHCID 7519AnisoleHCID 8058HexaneHCID 178485635HCID 178485635, compound

Product 1

HCID 178485636HCID 178485636, compound

Sources & evidence

ORD record
ord-ae2138d6b6c84f6cb0df5b20341e2807
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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