2-(Methylsulfonyl)ethanamine → HCID 68355377, compound

HRID 1629151Notes

Reaction equation

[F:1][C:2]([F:27])([F:26])[CH2:3][N:4]1[C:8]([C:9]2[N:10]=[C:11]3[C:17]4[CH:18]=[C:19]([C:22](O)=[O:23])[CH:20]=[CH:21][C:16]=4[O:15][CH2:14][CH2:13][N:12]3[CH:25]=2)=[N:7][CH:6]=[N:5]1.[CH3:28][S:29]([CH2:32][CH2:33][NH2:34])(=[O:31])=[O:30]>>[CH3:28][S:29]([CH2:32][CH2:33][NH:34][C:22]([C:19]1[CH:20]=[CH:21][C:16]2[O:15][CH2:14][CH2:13][N:12]3[CH:25]=[C:9]([C:8]4[N:4]([CH2:3][C:2]([F:27])([F:26])[F:1])[N:5]=[CH:6][N:7]=4)[N:10]=[C:11]3[C:17]=2[CH:18]=1)=[O:23])(=[O:31])=[O:30]

Participants

Reactant 2

HCID 43405612-(Methylsulfonyl)ethanamine

HCID 86652299HCID 86652299, compound

Product 1

HCID 68355377HCID 68355377, compound

Procedure

Following the procedure for 109, 2-(1-(2,2,2-trifluoroethyl)-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepine-10-carboxylic acid and 2-(methylsulfonyl)ethanamine gave 119. MS: (ESI+)=485.1. 1H NMR (400 MHz, DMSO) δ 8.93 (d, J=2.1 Hz, 1H), 8.72 (t, J=5.4 Hz, 1H), 8.10 (s, 2H), 7.78 (dd, J=8.6, 2.2 Hz, 1H), 7.14 (d, J=8.5 Hz, 1H), 5.94 (q, J=8.9 Hz, 2H), 4.58 (s, 4H), 3.69 (dd, J=12.7, 6.5 Hz, 2H), 3.38 (t, J=6.8 Hz, 2H), 3.04 (s, 3H)

Sources & evidence

ORD record: ord-49d3bbce22804a38b6a0bcaf08592140
Source dataset: uspto-grants-2014_07
DOI: 10.6084/m9.figshare.5104873.v1
Patent number: US08785626B2

Reaction notes

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