Hydrochloric Acid → HCID 178462483, compound

HRID 1126978Notes

Reaction equation

HRID 1126978 reaction equation
[C:1](#[N:2])[N:3]=[C:4]([NH:5][CH:6]1[C:7](=[O:23])[N:8]([CH2:21][CH3:22])[CH2:9][CH:10]([c:13]2[c:14]([F:20])[c:15]([F:19])[cH:16][cH:17][cH:18]2)[CH2:11][CH2:12]1)[O:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[CH2:58]([OH:59])[CH2:60][CH2:61][CH2:62][CH3:63].[CH:49]([N:50]([CH2:51][CH3:52])[CH:53]([CH3:54])[CH3:55])([CH3:56])[CH3:57].[ClH:31].[ClH:32].[O:33]=[c:34]1[n:35]([CH:43]2[CH2:44][CH2:45][NH:46][CH2:47][CH2:48]2)[c:36]2[c:37]([n:38][cH:39][cH:40][cH:41]2)[nH:42]1>>[C:1](#[N:2])[N:3]=[C:4]([NH:5][CH:6]1[C:7](=[O:23])[N:8]([CH2:21][CH3:22])[CH2:9][CH:10]([c:13]2[c:14]([F:20])[c:15]([F:19])[cH:16][cH:17][cH:18]2)[CH2:11][CH2:12]1)[N:46]1[CH2:45][CH2:44][CH:43]([n:35]2[c:34](=[O:33])[nH:42][c:37]3[c:36]2[cH:41][cH:40][cH:39][n:38]3)[CH2:48][CH2:47]1

Participants

6

Reactant 5

HCID 313Hydrochloric Acid2×HCID 62761-PentanolHCID 81531DiisopropylethylamineHCID 22293182Bms-973013HCID 178462484HCID 178462484, compound

Product 1

HCID 178462483HCID 178462483, compound

Sources & evidence

ORD record
ord-edfcc694861044e3bc6688a515dd7894
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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