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Hydrochloric Acid → 3-[5-Carbamoyl-4-(3-chloro-phenyl)-thiazol-2-ylamino]-4-nitro-benzoic acid

HRID 1552072
Notes
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Reaction equation

HRID 1552072 reaction equation
[C:30](=[O:31])([O-:32])[O-:33].[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[ClH:36].[Cs+:34].[Cs+:35].[F:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[OH:7])[cH:8][cH:9][c:10]1[N+:11](=[O:12])[O-:13].[NH2:14][c:15]1[s:16][c:17]([C:27](=[O:28])[NH2:29])[c:18](-[c:20]2[cH:21][c:22]([Cl:26])[cH:23][cH:24][cH:25]2)[n:19]1.[OH2:37]>>[c:2]1([NH:14][c:15]2[s:16][c:17]([C:27](=[O:28])[NH2:29])[c:18](-[c:20]3[cH:21][c:22]([Cl:26])[cH:23][cH:24][cH:25]3)[n:19]2)[cH:3][c:4]([C:5](=[O:6])[OH:7])[cH:8][cH:9][c:10]1[N+:11](=[O:12])[O-:13]
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 2306533-Fluoro-4-nitrobenzoic acidHCID 166588232-Amino-4-(3-chlorophenyl)thiazole-5-carboxamide

Product 1

HCID 866428143-[5-Carbamoyl-4-(3-chloro-phenyl)-thiazol-2-ylamino]-4-nitro-benzoic acid

Sources & evidence

ORD record
ord-6493da74cbaf4fcebbc5e440b55e77af
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes