3-[4-(1-Amino-cyclobutyl)-phenyl]-2-phenyl-7H-pyrano[2,3-e]indazol-4-one → 7-[4-(1-Amino-cyclobutyl)-phenyl]-6-phenyl-1H-4,5-dioxa-1-aza-phenanthrene-2,8-dione

HRID 158915Notes

Reaction equation

HRID 158915 reaction equation
[C:32]([O:33][C:34](=[O:35])[NH:38][C:39]1([c:43]2[cH:44][cH:45][c:46](-[c:49]3[c:50](-[c:65]4[cH:66][cH:67][cH:68][cH:69][cH:70]4)[o:51][c:52]4[c:53]5[c:58]([cH:59][cH:60][c:61]4[c:62]3=[O:63])[NH:57][C:56](=[O:64])[CH2:55][O:54]5)[cH:47][cH:48]2)[CH2:40][CH2:41][CH2:42]1)([CH3:36])([CH3:37])[CH3:71].[NH2:1][C:2]1([c:3]2[cH:4][cH:5][c:6](-[c:7]3[c:8](=[O:9])[c:10]4[c:11]([o:12][c:13]3-[c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[c:20]3[c:21]([cH:22][cH:23]4)[nH:24][n:25][cH:26]3)[cH:27][cH:28]2)[CH2:29][CH2:30][CH2:31]1>>[NH2:38][C:39]1([c:43]2[cH:44][cH:45][c:46](-[c:49]3[c:50](-[c:65]4[cH:66][cH:67][cH:68][cH:69][cH:70]4)[o:51][c:52]4[c:53]5[c:58]([cH:59][cH:60][c:61]4[c:62]3=[O:63])[NH:57][C:56](=[O:64])[CH2:55][O:54]5)[cH:47][cH:48]2)[CH2:40][CH2:41][CH2:42]1

Participants

3

Reactant 2

HCID 510295913-[4-(1-Amino-cyclobutyl)-phenyl]-2-phenyl-7H-pyrano[2,3-e]indazol-4-oneHCID 67067975{1-[4-(2,8-Dioxo-6-phenyl-1,2,3,8-tetrahydro-4,5-dioxa-1-aza-phenanthren-7-yl)-phenyl]cyclobutyl}-carbamic acid tert-butyl ester

Product 1

HCID 670676307-[4-(1-Amino-cyclobutyl)-phenyl]-6-phenyl-1H-4,5-dioxa-1-aza-phenanthrene-2,8-dione

Sources & evidence

ORD record
ord-0f91072512284a00b168db02bcc48f88
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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