Hydrochloric Acid → HCID 10233428, compound

HRID 95806Notes

Reaction equation

HRID 95806 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:6][CH:7]2[N:8]([CH:22]([C:23](=[O:24])[OH:25])[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[CH2:9][CH2:10][CH2:11][c:12]3[c:13]2[cH:14][c:15]([O:20][CH3:21])[c:16]([O:18][CH3:19])[cH:17]3)[cH:32][cH:33][c:34]1[O:35][CH3:36].[ClH:37].[s:38]1[n:39][n:40][c:41](-[c:43]2[cH:44][cH:45][c:46]([CH2:47][NH2:48])[cH:49][cH:50]2)[cH:42]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:6][CH:7]2[N:8]([CH:22]([C:23](=[O:24])[NH:48][CH2:47][c:46]3[cH:45][cH:44][c:43](-[c:41]4[n:40][n:39][s:38][cH:42]4)[cH:50][cH:49]3)[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[CH2:9][CH2:10][CH2:11][c:12]3[c:13]2[cH:14][c:15]([O:20][CH3:21])[c:16]([O:18][CH3:19])[cH:17]3)[cH:32][cH:33][c:34]1[O:35][CH3:36]

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 27372881-[4-(1,2,3-Thiadiazol-4-Yl)phenyl]methanamineHCID 18442565[1-(3,4-Dimethoxy-benzyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-benzo[c]azepin-2-yl]-phenyl-acetic acid

Product 1

HCID 10233428HCID 10233428, compound

Sources & evidence

ORD record
ord-4fccae46f75645b4af4e4f30ef0f0e27
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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