Hydrochloric Acid → 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-chloro-N-[1-(4-chlorophenyl)-1-hydroxypropan-2-yl]benzamide

반응식

[ClH:24].[NH2:25][CH:26]([CH:27]([OH:28])[c:29]1[cH:30][cH:31][c:32]([Cl:35])[cH:33][cH:34]1)[CH3:36].[n:1]1[c:2]2[c:3]([n:4][s:5]1)[c:6]([S:10](=[O:11])(=[O:12])[NH:13][c:14]1[c:15]([C:16](=[O:17])[OH:18])[cH:19][cH:20][c:21]([Cl:23])[cH:22]1)[cH:7][cH:8][cH:9]2>>[n:1]1[c:2]2[c:3]([n:4][s:5]1)[c:6]([S:10](=[O:11])(=[O:12])[NH:13][c:14]1[c:15]([C:16](=[O:18])[NH:25][CH:26]([CH:27]([OH:28])[c:29]3[cH:30][cH:31][c:32]([Cl:35])[cH:33][cH:34]3)[CH3:36])[cH:19][cH:20][c:21]([Cl:23])[cH:22]1)[cH:7][cH:8][cH:9]2

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 1526614-Chloronorephedrine

HCID 160906632-(Benzo[1,2,5]thiadiazole-4-sulfonylamino)-4-chlorobenzoic acid

생성물 1

HCID 708276682-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-chloro-N-[1-(4-chlorophenyl)-1-hydroxypropan-2-yl]benzamide

출처 및 근거

ORD 기록: ord-aecedb16d99f46daa1ce5a69aa091c3d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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