Hydrochloric Acid → 4'-methoxy-N-(3-(5-(N-(4-methoxybenzyl)sulfamoyl)-benzo[d]isothiazol-3-ylamino)propyl)biphenyl-4-carboxamide

HRID 203852

반응식

HRID 203852 반응식
[C:18]([P:19](=[O:20])([O:21][CH2:22][CH3:23])[O:24][CH2:25][CH3:26])#[N:27].[CH2:62]([Cl:63])[Cl:64].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([C:15](=[O:16])[OH:17])[cH:13][cH:14]2)[cH:7][cH:8]1.[CH3:28][N:29]1[CH2:30][CH2:31][O:32][CH2:33][CH2:34]1.[ClH:65].[NH2:35][CH2:36][CH2:37][CH2:38][NH:39][c:40]1[n:41][s:42][c:43]2[c:44]1[cH:45][c:46]([S:49](=[O:50])(=[O:51])[NH:52][CH2:53][c:54]1[cH:55][cH:56][c:57]([O:60][CH3:61])[cH:58][cH:59]1)[cH:47][cH:48]2>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([C:15](=[O:17])[NH:35][CH2:36][CH2:37][CH2:38][NH:39][c:40]3[n:41][s:42][c:43]4[c:44]3[cH:45][c:46]([S:49](=[O:50])(=[O:51])[NH:52][CH2:53][c:54]3[cH:55][cH:56][c:57]([O:60][CH3:61])[cH:58][cH:59]3)[cH:47][cH:48]4)[cH:13][cH:14]2)[cH:7][cH:8]1

참가 물질

7

반응물 6

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 79724-MethylmorpholineHCID 76257Diethyl cyanophosphonateHCID 27595524'-Methoxy(1,1'-biphenyl)-4-carboxylic acidHCID 587270883-(3-aminopropylamino)-N-(4-methoxybenzyl)benzo[d]isothiazole-5-sulfonamide

생성물 1

HCID 587269084'-methoxy-N-(3-(5-(N-(4-methoxybenzyl)sulfamoyl)-benzo[d]isothiazol-3-ylamino)propyl)biphenyl-4-carboxamide

출처 및 근거

ORD 기록
ord-73e8a03cae014971b1090b51b4594b27
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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