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Dichloromethane → Methanesulphonic Acid 1-{4-[1-(4-cyclohex-1-enyl-phenyl)-3-(3,5-dichlorophenyl)-ureidomethyl]phenyl}-2-(2H-tetrazol-5-yl)ethyl Ester

HRID 824897
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HRID 824897 반응식
[C:1]1([c:7]2[cH:8][cH:9][c:10]([N:13]([C:14](=[O:15])[NH:16][c:17]3[cH:18][c:19]([Cl:24])[cH:20][c:21]([Cl:23])[cH:22]3)[CH2:25][c:26]3[cH:27][cH:28][c:29]([CH:32]([CH2:33][c:34]4[n:35][n:36][nH:37][n:38]4)[OH:39])[cH:30][cH:31]3)[cH:11][cH:12]2)=[CH:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[CH2:40]([N:41]([CH2:42][CH3:43])[CH2:44][CH3:45])[CH3:46].[CH3:47][S:48](=[O:49])(=[O:50])[Cl:51].[Cl:63][CH2:64][Cl:65].[N:52]12[CH2:53][CH2:54][CH2:55][N:56]=[C:57]1[CH2:58][CH2:59][CH2:60][CH2:61][CH2:62]2>>[C:1]1([c:7]2[cH:8][cH:9][c:10]([N:13]([C:14](=[O:15])[NH:16][c:17]3[cH:18][c:19]([Cl:24])[cH:20][c:21]([Cl:23])[cH:22]3)[CH2:25][c:26]3[cH:27][cH:28][c:29]([CH:32]([CH2:33][c:34]4[n:35][n:36][nH:37][n:38]4)[O:39][S:48]([CH3:47])(=[O:49])=[O:50])[cH:30][cH:31]3)[cH:11][cH:12]2)=[CH:2][CH2:3][CH2:4][CH2:5][CH2:6]1
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반응물 5

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 31297Methanesulfonyl chlorideHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 187689131-(4-Cyclohex-1-enylphenyl)-3-(3,5-dichlorophenyl)-1-{4-[1-hydroxy-2-(2H-tetrazol-5-yl)ethyl]benzyl}urea

생성물 1

HCID 20601515
Methanesulphonic Acid 1-{4-[1-(4-cyclohex-1-enyl-phenyl)-3-(3,5-dichlorophenyl)-ureidomethyl]phenyl}-2-(2H-tetrazol-5-yl)ethyl Ester

출처 및 근거

ORD 기록
ord-ce639cb8a16f4d43ab3a0c0f49e7a2a4
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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