Hydrochloric Acid → HCID 22293295, compound

HRID 2142429Notes

Reaction equation

HRID 2142429 reaction equation
[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH:40]([N:41]([CH:42]([CH3:43])[CH3:44])[CH2:45][CH3:46])([CH3:47])[CH3:48].[Cl:27][C:28](=[O:29])[O:30][c:31]1[cH:32][cH:33][c:34]([N+:35]([O-:36])=[O:37])[cH:38][cH:39]1.[Cl:72][CH2:73][Cl:74].[ClH:49].[ClH:50].[NH2:8][CH:9]1[C:10](=[O:26])[N:11]([CH2:22][CH:23]2[CH2:24][CH2:25]2)[CH2:12][CH:13]([c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[O:14][CH2:15]1.[O:51]=[c:52]1[n:53]([CH:61]2[CH2:62][CH2:63][NH:64][CH2:65][CH2:66]2)[c:54]2[c:55]([n:56][cH:57][cH:58][cH:59]2)[nH:60]1.[O:67]1[CH2:68][CH2:69][CH2:70][CH2:71]1>>[NH:8]([CH:9]1[C:10](=[O:26])[N:11]([CH2:22][CH:23]2[CH2:24][CH2:25]2)[CH2:12][CH:13]([c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[O:14][CH2:15]1)[C:28](=[O:29])[N:64]1[CH2:63][CH2:62][CH:61]([n:53]2[c:52](=[O:51])[nH:60][c:55]3[c:54]2[cH:59][cH:58][cH:57][n:56]3)[CH2:66][CH2:65]1

Participants

9

Reactant 8

HCID 313Hydrochloric Acid2×HCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 81531DiisopropylethylamineHCID 821294-Nitrophenyl chloroformateHCID 22293182Bms-973013HCID 22293247HCID 22293247, compound

Product 1

HCID 22293295HCID 22293295, compound

Sources & evidence

ORD record
ord-747790088bb1493d9ccda1687b7d6d36
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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