Hydrochloric Acid → HCID 59496613, compound

HRID 2146780Notes

Reaction equation

HRID 2146780 reaction equation
[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:46][C:47]#[N:48].[CH3:6][N:7]1[CH2:8][CH2:9][N:10]([c:13]2[n:14][c:15]([NH2:37])[n:16][c:17](-[c:19]3[cH:20][cH:21][c:22]4[c:27]([cH:28]3)[CH2:26][N:25]([C:29]([CH2:30][CH:31]3[CH2:32][NH:33][CH2:34][CH2:35]3)=[O:36])[CH2:24][CH2:23]4)[cH:18]2)[CH2:11][CH2:12]1.[Cl:1][C:2](=[O:3])[O:4][CH3:5].[ClH:38]>>[C:2](=[O:3])([O:4][CH3:5])[N:33]1[CH2:32][CH:31]([CH2:30][C:29]([N:25]2[CH2:24][CH2:23][c:22]3[cH:21][cH:20][c:19](-[c:17]4[n:16][c:15]([NH2:37])[n:14][c:13]([N:10]5[CH2:9][CH2:8][N:7]([CH3:6])[CH2:12][CH2:11]5)[cH:18]4)[cH:28][c:27]3[CH2:26]2)=[O:36])[CH2:35][CH2:34]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6342AcetonitrileHCID 6586Methyl chloroformateHCID 8471TriethylamineHCID 59496632HCID 59496632, compound

Product 1

HCID 59496613HCID 59496613, compound

Sources & evidence

ORD record
ord-84d5788a3e6344e2a8047064376b8d45
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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