1,2-Dichloroethane → 2-(4-Oxo-2a,3,4,5-tetrahydropyrrolo[4,3,2-de]quinolin-1(2H)-yl)-N-(2'-oxo-1,1',2',3-tetrahydrospiro[indene-2,3'-pyrrolo[2,3-b]pyridin]-5-yl)acetamide

HRID 2126577Notes

Reaction equation

HRID 2126577 reaction equation
[CH2:38]([Cl:39])[CH2:40][Cl:41].[CH:52]([N:53]([CH2:54][CH3:55])[CH:56]([CH3:57])[CH3:58])([CH3:59])[CH3:60].[Li+:37].[NH2:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[CH2:7][C:6]1([CH2:5]2)[C:11](=[O:19])[NH:12][c:13]2[n:14][cH:15][cH:16][cH:17][c:18]21.[O:20]=[C:21]1[NH:22][c:23]2[cH:24][cH:25][cH:26][c:27]3[c:28]2[CH:29]([CH2:30]1)[CH2:31][N:32]3[CH2:33][C:34](=[O:35])[O-:36].[O:61]=[CH:62][N:63]([CH3:64])[CH3:65].[OH:42][n:43]1[c:44]2[c:45]([cH:46][cH:47][cH:48][cH:49]2)[n:50][n:51]1>>[NH:1]([c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[CH2:7][C:6]1([CH2:5]2)[C:11](=[O:19])[NH:12][c:13]2[n:14][cH:15][cH:16][cH:17][c:18]21)[C:34]([CH2:33][N:32]1[c:27]2[cH:26][cH:25][cH:24][c:23]3[c:28]2[CH:29]([CH2:30][C:21](=[O:20])[NH:22]3)[CH2:31]1)=[O:35]

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 6228DimethylformamideHCID 28486Lithium ionHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 591667225-amino-1,3-dihydrospiro[indene-2,3'-pyrrolo[2,3-b]pyridin]-2'(1'H)-oneHCID 592578342-(6-Oxo-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(11),8(12),9-trien-2-yl)acetate

Product 1

HCID 115544992-(4-Oxo-2a,3,4,5-tetrahydropyrrolo[4,3,2-de]quinolin-1(2H)-yl)-N-(2'-oxo-1,1',2',3-tetrahydrospiro[indene-2,3'-pyrrolo[2,3-b]pyridin]-5-yl)acetamide

Sources & evidence

ORD record
ord-15e19e6b9d1142efb75f7983395055f2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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