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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Water → N-(3-(1-ethyl-3,3,5-trimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-benzo[b][1,4]diazepin-7-yloxy)propyl)-N-(2-(7-methyl-1-oxo-1H-isoquinolin-2-yl)ethyl)-2-nitrobenzenesulfonamide

HRID 803074
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인쇄 미리보기

반응식

HRID 803074 반응식
[CH2:14]1[O:15][CH2:16][CH2:17][CH2:18]1.[CH2:19]([CH3:20])[N:21]1[c:22]2[c:23]([cH:33][c:34]([O:37][CH2:38][CH2:39][CH2:40][NH:41][S:42](=[O:43])(=[O:44])[c:45]3[c:46]([N+:51](=[O:52])[O-:53])[cH:47][cH:48][cH:49][cH:50]3)[cH:35][cH:36]2)[N:24]([CH3:32])[C:25](=[O:31])[C:26]([CH3:29])([CH3:30])[C:27]1=[O:28].[CH2:1]([P:2]([CH2:3][CH2:4][CH2:5][CH3:6])[CH2:7][CH2:8][CH2:9][CH3:10])[CH2:11][CH2:12][CH3:13].[Cl:69][CH2:70][Cl:71].[OH2:72].[OH:54][CH2:55][CH2:56][n:57]1[c:58](=[O:68])[c:59]2[cH:60][c:61]([CH3:67])[cH:62][cH:63][c:64]2[cH:65][cH:66]1>>[CH2:19]([CH3:20])[N:21]1[c:22]2[c:23]([cH:33][c:34]([O:37][CH2:38][CH2:39][CH2:40][N:41]([S:42](=[O:43])(=[O:44])[c:45]3[c:46]([N+:51](=[O:52])[O-:53])[cH:47][cH:48][cH:49][cH:50]3)[CH2:55][CH2:56][n:57]3[c:58](=[O:68])[c:59]4[cH:60][c:61]([CH3:67])[cH:62][cH:63][c:64]4[cH:65][cH:66]3)[cH:35][cH:36]2)[N:24]([CH3:32])[C:25](=[O:31])[C:26]([CH3:29])([CH3:30])[C:27]1=[O:28]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 962WaterHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 13831TributylphosphineHCID 68672787N-(3-(1-ethyl-3,3,5-trimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-benzo[b][1,4]diazepin-7-yloxy)propyl)-2-nitrobenzenesulfonamideHCID 686736362-(2-hydroxyethyl)-7-methyl-2H-isoquinolin-1-one

생성물 1

HCID 68672764N-(3-(1-ethyl-3,3,5-trimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-benzo[b][1,4]diazepin-7-yloxy)propyl)-N-(2-(7-methyl-1-oxo-1H-isoquinolin-2-yl)ethyl)-2-nitrobenzenesulfonamide

출처 및 근거

ORD 기록
ord-d4f14a8540e645da9f638b844e4b1453
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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