Benzene → HCID 21530396, compound

HRID 1560887Notes

Reaction equation

HRID 1560887 reaction equation
[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[Cl:1][C:2]([Cl:3])=[O:4].[N:5]1([C:10]2=[CH:11][CH2:12][CH2:13][S:14](=[O:21])(=[O:22])[c:15]3[c:16]2[cH:17][cH:18][cH:19][cH:20]3)[CH2:6][CH2:7][CH2:8][CH2:9]1.[NH2:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1.[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1.[cH:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[C:2](=[O:4])([C:11]1=[C:10]([N:5]2[CH2:6][CH2:7][CH2:8][CH2:9]2)[c:16]2[c:15]([cH:20][cH:19][cH:18][cH:17]2)[S:14](=[O:21])(=[O:22])[CH2:13][CH2:12]1)[NH:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1

Participants

7

Reactant 6

HCID 241BenzeneHCID 6115AnilineHCID 6371PhosgeneHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 21530393HCID 21530393, compound

Product 1

HCID 21530396HCID 21530396, compound

Sources & evidence

ORD record
ord-c9081a76c7074b0ab7e5b44845b094a8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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