Dimethylformamide → 5-Bromo-2-(2-cyclobutoxy-3-methyl-benzoylamino)-indan-2-carboxylic acid ethyl ester

HRID 1548841Notes

Reaction equation

HRID 1548841 reaction equation
[CH2:16]([CH3:17])[O:18][C:19](=[O:20])[C:21]1([NH2:31])[CH2:22][c:23]2[cH:24][cH:25][c:26]([Br:30])[cH:27][c:28]2[CH2:29]1.[CH:1]1([O:5][c:6]2[c:7]([C:8](=[O:9])[OH:10])[cH:11][cH:12][cH:13][c:14]2[CH3:15])[CH2:2][CH2:3][CH2:4]1.[CH:56]([N:57]([CH2:58][CH3:59])[CH:60]([CH3:61])[CH3:62])([CH3:63])[CH3:64].[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[P-:32]([F:33])([F:34])([F:35])([F:36])([F:37])[F:38].[n:39]1([O:40][C:41]([N:42]([CH3:43])[CH3:44])=[N+:45]([CH3:46])[CH3:47])[c:48]2[n:49][cH:50][cH:51][cH:52][c:53]2[n:54][n:55]1>>[CH:1]1([O:5][c:6]2[c:7]([C:8](=[O:10])[NH:31][C:21]3([C:19]([O:18][CH2:16][CH3:17])=[O:20])[CH2:22][c:23]4[cH:24][cH:25][c:26]([Br:30])[cH:27][c:28]4[CH2:29]3)[cH:11][cH:12][cH:13][c:14]2[CH3:15])[CH2:2][CH2:3][CH2:4]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 593141552-Cyclobutyloxy-3-methylbenzoic acidHCID 59314228Ethyl 2-amino-5-bromo-2,3-dihydro-1H-indene-2-carboxylate

Product 1

HCID 593143855-Bromo-2-(2-cyclobutoxy-3-methyl-benzoylamino)-indan-2-carboxylic acid ethyl ester

Sources & evidence

ORD record
ord-cd09df9d2b2d470ca2c19513ec7b1ab9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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