홈MCP워크벤치Skills
홈워크벤치알림마이페이지
llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
  1. 홈
  2. /반응

Hydrochloric Acid → Ethyl 3-[9-(5-{3-cyano-4-[(1-methylethyl)oxy]phenyl}-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]propanoate

HRID 167931
노트
인쇄 미리보기

반응식

HRID 167931 반응식
[Br:39][CH2:40][CH2:41][C:42](=[O:43])[O:44][CH2:45][CH3:46].[CH3:2][CH:3]([CH3:4])[O:5][c:6]1[c:7]([C:8]#[N:9])[cH:10][c:11](-[c:14]2[n:15][c:16](-[c:19]3[cH:20][cH:21][cH:22][c:23]4[c:29]3[O:28][CH2:27][CH2:26][NH:25][CH2:24]4)[n:17][o:18]2)[cH:12][cH:13]1.[CH3:47][C:48]#[N:49].[CH:30]([N:31]([CH2:32][CH3:33])[CH:34]([CH3:35])[CH3:36])([CH3:37])[CH3:38].[ClH:1]>>[CH3:2][CH:3]([CH3:4])[O:5][c:6]1[c:7]([C:8]#[N:9])[cH:10][c:11](-[c:14]2[n:15][c:16](-[c:19]3[cH:20][cH:21][cH:22][c:23]4[c:29]3[O:28][CH2:27][CH2:26][N:25]([CH2:40][CH2:41][C:42](=[O:43])[O:44][CH2:45][CH3:46])[CH2:24]4)[n:17][o:18]2)[cH:12][cH:13]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 313Hydrochloric AcidHCID 6342AcetonitrileHCID 68320Ethyl 3-bromopropionateHCID 81531DiisopropylethylamineHCID 44129064HCID 44129064, 화합물

생성물 1

HCID 59403543Ethyl 3-[9-(5-{3-cyano-4-[(1-methylethyl)oxy]phenyl}-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]propanoate

출처 및 근거

ORD 기록
ord-e97a9d10c8bb4dbcb17f75535db99ea5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트