(-)-4-[4-[2-(Isochroman-1-yl)ethyl]piperazin-1-yl]benzamide → 4-[4-[2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]-1,4-diazepan-1-yl]benzenesulfonamide

HRID 1567647

Reaction equation

HRID 1567647 reaction equation
[CH:1]1([CH2:11][CH2:12][OH:13])[O:2][CH2:3][CH2:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21.[CH:31]1([CH2:32][CH2:33][N:34]2[CH2:35][CH2:36][N:37]([c:38]3[cH:39][cH:40][c:41]([C:42]([NH2:43])=[O:44])[cH:45][cH:46]3)[CH2:47][CH2:48]2)[c:49]2[c:50]([cH:51][cH:52][cH:53][cH:54]2)[CH2:55][CH2:56][O:57]1.[Cl:58][CH2:59][CH2:60][CH:61]1[c:62]2[c:63]([cH:64][cH:65][cH:66][cH:67]2)[CH:68]([CH3:69])[CH2:70][O:71]1.[N:14]1([c:21]2[cH:22][cH:23][c:24]([S:27](=[O:28])(=[O:29])[NH2:30])[cH:25][cH:26]2)[CH2:15][CH2:16][NH:17][CH2:18][CH2:19][CH2:20]1.[c:72]1([CH2:73][CH:74]2[CH2:75][O:76][C:77](=[O:78])[N:79]2[C:80](=[O:81])[CH:82]([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[CH3:89])[cH:90][cH:91][cH:92][cH:93][cH:94]1>>[CH:1]1([CH2:11][CH2:12][N:17]2[CH2:16][CH2:15][N:14]([c:21]3[cH:22][cH:23][c:24]([S:27](=[O:28])(=[O:29])[NH2:30])[cH:25][cH:26]3)[CH2:20][CH2:19][CH2:18]2)[O:2][CH2:3][CH2:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21

Participants

6

Reactant 5

HCID 10270210(-)-4-[4-[2-(Isochroman-1-yl)ethyl]piperazin-1-yl]benzamideHCID 14141298(-)-2-(Isochroman-1-yl)ethanolHCID 177928954-(Homopiperazin-1-yl)benzenesulfonamideHCID 226306994-Benzyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-oneHCID 232889381-(2-Chloroethyl)-4-methyl-isochroman

Product 1

HCID 232888374-[4-[2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]-1,4-diazepan-1-yl]benzenesulfonamide

Sources & evidence

ORD record
ord-5537247ef4f943b88d58366db4d674aa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Linked notes

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