Hydrochloric Acid → HCID 59361841, compound

HRID 154002Notes

Reaction equation

HRID 154002 reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[cH:6][c:7]2[c:8]([NH:22][c:23]3[cH:24][c:25]4[cH:26][n:27][n:28]([C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[c:29]4[cH:30][cH:31]3)[n:9][c:10](-[c:15]3[cH:16][c:17]([NH2:21])[cH:18][cH:19][cH:20]3)[n:11][c:12]2[cH:13][cH:14]1.[C:40]([c:41]1[cH:42][n:43][cH:44][cH:45][cH:46]1)(=[O:47])[Cl:48].[CH:49]([N:50]([CH2:51][CH3:52])[CH:53]([CH3:54])[CH3:55])([CH3:56])[CH3:57].[Cl:58][CH2:59][Cl:60].[ClH:39]>>[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[cH:6][c:7]2[c:8]([NH:22][c:23]3[cH:24][c:25]4[cH:26][n:27][n:28]([C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[c:29]4[cH:30][cH:31]3)[n:9][c:10](-[c:15]3[cH:16][c:17]([NH:21][C:40]([c:41]4[cH:42][n:43][cH:44][cH:45][cH:46]4)=[O:47])[cH:18][cH:19][cH:20]3)[n:11][c:12]2[cH:13][cH:14]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 82604Nicotinoyl chlorideHCID 59361927HCID 59361927, compound

Product 1

HCID 59361841HCID 59361841, compound

Sources & evidence

ORD record
ord-e09e5bf4558b48649325832048cffd16
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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