Acetonitrile → N-({6-[(2-Fluoroethyl)amino]-4-(methylthio)pyridin-2-yl}carbamoyl)-5-(2-methoxyethyl)-4-methylthiophene-2-sulfonamide

HRID 2136111Notes

Reaction equation

HRID 2136111 reaction equation
[CH3:1][O:2][CH2:3][CH2:4][c:5]1[c:6]([CH3:14])[cH:7][c:8]([S:10](=[O:11])(=[O:12])[NH2:13])[s:9]1.[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[CH3:45][C:46]#[N:47].[Cl:15][C:16](=[O:17])[O:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1.[F:32][CH2:33][CH2:34][NH:35][c:36]1[n:37][c:38]([NH2:44])[cH:39][c:40]([S:42][CH3:43])[cH:41]1>>[CH3:1][O:2][CH2:3][CH2:4][c:5]1[c:6]([CH3:14])[cH:7][c:8]([S:10](=[O:11])(=[O:12])[NH:13][C:16](=[O:17])[NH:44][c:38]2[n:37][c:36]([NH:35][CH2:34][CH2:33][F:32])[cH:41][c:40]([S:42][CH3:43])[cH:39]2)[s:9]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 15891Phenyl chloroformateHCID 67274431HCID 67274431, compoundHCID 86630931HCID 86630931, compound

Product 1

HCID 42629873N-({6-[(2-Fluoroethyl)amino]-4-(methylthio)pyridin-2-yl}carbamoyl)-5-(2-methoxyethyl)-4-methylthiophene-2-sulfonamide

Sources & evidence

ORD record
ord-e55c7939d04e40b9b8ad9f8c5be9cb11
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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