Water → HCID 178523247, compound

HRID 108387Notes

Reaction equation

HRID 108387 reaction equation
[C:1]([c:2]1[nH:3][cH:4][cH:5][n:6]1)([c:7]1[nH:8][cH:9][cH:10][n:11]1)=[O:12].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[Cl:13][c:14]1[cH:15][c:16]2[c:17]([S:26](=[O:27])(=[O:28])[c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[c:18]([C:23](=[O:24])[OH:25])[nH:19][c:20]2[cH:21][cH:22]1.[NH2:35][CH2:36][CH2:37][c:38]1[cH:39][nH:40][cH:41][n:42]1.[OH2:49]>>[Cl:13][c:14]1[cH:15][c:16]2[c:17]([S:26](=[O:27])(=[O:28])[c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[c:18]([C:23](=[O:24])[NH:35][CH2:36][CH2:37][c:38]3[cH:39][nH:40][cH:41][n:42]3)[nH:19][c:20]2[cH:21][cH:22]1

Participants

6

Reactant 5

HCID 962WaterHCID 8857Ethyl AcetateHCID 5250894Bis-(1H-imidazol-2-YL)-methanoneHCID 158135163-Phenylsulfonyl-5-chloroindole-2-carboxylic acidHCID 178419017HCID 178419017, compound

Product 1

HCID 178523247HCID 178523247, compound

Sources & evidence

ORD record
ord-862fffa186a34b8e894b3f615cbe48be
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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