Hydrochloric Acid → Hydrochloric Acid

HRID 2145636Notes

Reaction equation

HRID 2145636 reaction equation
[CH3:22][N:23]1[CH2:24][c:25]2[cH:26][c:27]([CH:28]=[CH:29][C:30]([OH:31])=[O:32])[cH:33][n:34][c:35]2[NH:36][C:37](=[O:38])[CH2:39]1.[CH3:40][c:41]1[c:42]([CH2:50][NH:51][CH3:52])[s:43][c:44]2[s:45][cH:46][c:47]([CH3:49])[c:48]12.[CH3:53][NH:54][CH2:55][c:56]1[cH:57][cH:58][c:59]2[c:60]([cH:61][cH:62][cH:63][cH:64]2)[c:65]1[CH2:66][CH2:67][CH3:68].[ClH:1].[ClH:21].[NH2:2][c:3]1[c:4]([CH2:14][N:15]2[CH2:16][CH2:17][O:18][CH2:19][CH2:20]2)[cH:5][c:6]([CH:9]=[CH:10][C:11](=[O:12])[OH:13])[cH:7][n:8]1>>[ClH:1].[NH2:2][c:3]1[c:4]([CH2:14][N:15]2[CH2:16][CH2:17][O:18][CH2:19][CH2:20]2)[cH:5][c:6]([CH:9]=[CH:10][C:11](=[O:13])[N:51]([CH2:50][c:42]2[c:41]([CH3:40])[c:48]3[c:44]([s:43]2)[s:45][cH:46][c:47]3[CH3:49])[CH3:52])[cH:7][n:8]1

Participants

7

Reactant 5

HCID 313Hydrochloric Acid2×HCID 225937563,4-Dimethyl-2-(methylaminomethyl)thieno[2,3-b]thiopheneHCID 59456959Methyl-(1-propyl-naphthalen-2-ylmethyl)amineHCID 669662013-(4-Methyl-2-oxo-2,3,4,5-tetrahydro-1H-pyrido[2,3-e][1,4]diazepin-7-yl)-acrylic acidHCID 669662953-[6-Amino-5-(morpholin-4-ylmethyl)-3-pyridinyl]prop-2-enoic acid

Product 2

HCID 313Hydrochloric AcidHCID 669663103-[6-amino-5-(morpholin-4-ylmethyl)-3-pyridinyl]-N-[(3,4-dimethylthieno[2,3-b]thiophen-5-yl)methyl]-N-methylprop-2-enamide

Sources & evidence

ORD record
ord-6563afc3a0634342a640f47a384f1b5b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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