Hydrochloric Acid → HCID 178434769, compound

HRID 2147261Notes

Reaction equation

HRID 2147261 reaction equation
[CH3:24][c:25]1[n:26][o:27][c:28]([CH:30]([CH3:31])[NH2:32])[n:29]1.[CH3:34][N:35]([CH3:36])[CH2:37][CH2:38][CH2:39][N:40]=[C:41]=[N:42][CH2:43][CH3:44].[CH3:55][N:56]1[CH2:57][CH2:58][O:59][CH2:60][CH2:61]1.[CH3:62][N:63]([CH3:64])[CH:65]=[O:66].[Cl:1][c:2]1[c:3](-[c:8]2[n:9][n:10]([CH:20]([CH3:21])[CH3:22])[c:11]3[cH:12][c:13]([C:17](=[O:18])[OH:19])[cH:14][cH:15][c:16]23)[cH:4][cH:5][cH:6][cH:7]1.[ClH:23].[ClH:33].[OH:45][n:46]1[c:47]2[n:48][cH:49][cH:50][cH:51][c:52]2[n:53][n:54]1>>[Cl:1][c:2]1[c:3](-[c:8]2[n:9][n:10]([CH:20]([CH3:21])[CH3:22])[c:11]3[cH:12][c:13]([C:17](=[O:19])[NH:32][CH:30]([c:28]4[o:27][n:26][c:25]([CH3:24])[n:29]4)[CH3:31])[cH:14][cH:15][c:16]23)[cH:4][cH:5][cH:6][cH:7]1

Participants

8

Reactant 7

HCID 313Hydrochloric Acid2×HCID 6228DimethylformamideHCID 79724-MethylmorpholineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 181649HOAtHCID 431068281-(3-Methyl-1,2,4-oxadiazol-5-yl)ethanamineHCID 666615033-(2-Chlorophenyl)-1-isopropyl-1H-indazole-6-carboxylic acid

Product 1

HCID 178434769HCID 178434769, compound

Sources & evidence

ORD record
ord-bb2c59115d124e968be30a25b24ee889
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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