4-Phenyl-5-(trifluoromethyl)thiophene-2-carboxylic acid → HCID 178473817, compound

HRID 142970Notes

Reaction equation

HRID 142970 reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][CH:7]([C:10](=[O:11])[N:12]2[CH2:13][CH:14]([c:20]3[cH:21][c:22]([Cl:27])[c:23]([Cl:26])[cH:24][cH:25]3)[CH:15]([NH:18][CH3:19])[CH2:16][CH2:17]2)[CH2:8][CH2:9]1.[c:28]1(-[c:34]2[cH:35][c:36]([C:43](=[O:44])[OH:45])[s:37][c:38]2[C:39]([F:40])([F:41])[F:42])[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][CH:7]([C:10](=[O:11])[N:12]2[CH2:13][CH:14]([c:20]3[cH:21][c:22]([Cl:27])[c:23]([Cl:26])[cH:24][cH:25]3)[CH:15]([N:18]([CH3:19])[C:43]([c:36]3[cH:35][c:34](-[c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[c:38]([C:39]([F:40])([F:41])[F:42])[s:37]3)=[O:45])[CH2:16][CH2:17]2)[CH2:8][CH2:9]1

Participants

3

Reactant 2

HCID 27833724-Phenyl-5-(trifluoromethyl)thiophene-2-carboxylic acidHCID 689300921-[4-[3-(3,4-Dichlorophenyl)-4-(methylamino)piperidine-1-carbonyl]piperidin-1-yl]ethanone

Product 1

HCID 178473817HCID 178473817, compound

Sources & evidence

ORD record
ord-de5e8a236290430ca0cf38b53f3b917e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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