Sodium ion → HCID 178459196, compound

HRID 1551288Notes

Reaction equation

HRID 1551288 reaction equation
[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[Cl:34][C:35](=[O:36])[O:37][c:38]1[cH:39][cH:40][c:41]([N+:42]([O-:43])=[O:44])[cH:45][cH:46]1.[NH2:8][CH:9]1[c:10]2[n:11]([c:24]([C:27]([CH3:28])([O:29][CH2:30][CH2:31][OH:32])[CH3:33])[cH:25][n:26]2)[CH2:12][CH:13]([c:16]2[c:17]([F:23])[c:18]([F:22])[cH:19][cH:20][cH:21]2)[CH2:14][CH2:15]1.[NH:47]1[CH2:48][CH2:49][CH:50]([N:53]2[C:54](=[O:63])[NH:55][c:56]3[cH:57][cH:58][cH:59][cH:60][c:61]3[CH2:62]2)[CH2:51][CH2:52]1.[Na+:64].[Na+:65].[O-:66][C:67](=[O:68])[O-:69].[O:70]1[CH2:71][CH2:72][CH2:73][CH2:74]1>>[NH:8]([CH:9]1[c:10]2[n:11]([c:24]([C:27]([CH3:28])([O:29][CH2:30][CH2:31][OH:32])[CH3:33])[cH:25][n:26]2)[CH2:12][CH:13]([c:16]2[c:17]([F:23])[c:18]([F:22])[cH:19][cH:20][cH:21]2)[CH2:14][CH2:15]1)[C:35](=[O:36])[N:47]1[CH2:48][CH2:49][CH:50]([N:53]2[C:54](=[O:63])[NH:55][c:56]3[cH:57][cH:58][cH:59][cH:60][c:61]3[CH2:62]2)[CH2:51][CH2:52]1

Participants

8

Reactant 7

HCID 923Sodium ion2×HCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 19660Carbonate IonHCID 821294-Nitrophenyl chloroformateHCID 110425973-(Piperidin-4-yl)-3,4-dihydroquinazolin-2(1H)-oneHCID 67533533HCID 67533533, compound

Product 1

HCID 178459196HCID 178459196, compound

Sources & evidence

ORD record
ord-229e4ba766d14937bfebc04d7ca197eb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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