Hydrochloric Acid → Hydrochloric Acid

HRID 120606Notizen

Reaktionsgleichung

Reaktionsgleichung von HRID 120606
[CH3:21][N:22]1[CH2:23][c:24]2[cH:25][c:26]([CH:27]=[CH:28][C:29]([OH:30])=[O:31])[cH:32][n:33][c:34]2[NH:35][C:36](=[O:37])[CH2:38]1.[CH3:39][NH:40][CH2:41][c:42]1[c:43]([CH3:51])[c:44]2[c:45]([s:46]1)[cH:47][cH:48][cH:49][cH:50]2.[CH3:52][NH:53][CH2:54][c:55]1[cH:56][cH:57][c:58]2[c:59]([cH:60][cH:61][cH:62][cH:63]2)[c:64]1[CH2:65][CH2:66][CH3:67].[ClH:20].[NH2:1][c:2]1[c:3]([CH2:13][N:14]2[CH2:15][CH2:16][O:17][CH2:18][CH2:19]2)[cH:4][c:5]([CH:8]=[CH:9][C:10](=[O:11])[OH:12])[cH:6][n:7]1>>[ClH:20].[NH2:1][c:2]1[c:3]([CH2:13][N:14]2[CH2:15][CH2:16][O:17][CH2:18][CH2:19]2)[cH:4][c:5]([CH:8]=[CH:9][C:10](=[O:12])[N:40]([CH3:39])[CH2:41][c:42]2[c:43]([CH3:51])[c:44]3[c:45]([s:46]2)[cH:47][cH:48][cH:49][cH:50]3)[cH:6][n:7]1

Komponenten

7

Edukt 5

HCID 313Hydrochloric AcidHCID 22593745N-methyl(3-methylbenzo[b]thiophen-2-yl)methanamineHCID 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

Produkt 2

HCID 313Hydrochloric AcidHCID 669672773-[6-amino-5-(morpholin-4-ylmethyl)-3-pyridinyl]-N-methyl-N-[(3-methyl-1-benzothiophen-2-yl)methyl]prop-2-enamide

Quellen und Nachweise

ORD-Eintrag
ord-3fcb6114ed5e46749100b7bee9f28647
Quelldatensatz
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

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