Chloroform → Oxcarbazepine

반응식

[CH:24]([Cl:25])([Cl:26])[Cl:27].[Cl:17][S:18](=[O:19])(=[O:20])[N:21]=[C:22]=[O:23].[O:1]=[C:2]1[CH2:3][c:4]2[c:5]([cH:13][cH:14][cH:15][cH:16]2)[NH:6][c:7]2[c:8]1[cH:9][cH:10][cH:11][cH:12]2>>[O:1]=[C:2]1[CH2:3][c:4]2[c:5]([cH:13][cH:14][cH:15][cH:16]2)[N:6]([C:22]([NH2:21])=[O:23])[c:7]2[c:8]1[cH:9][cH:10][cH:11][cH:12]2

참가 물질

반응물 3

HCID 6212Chloroform

HCID 70918Chlorosulfonyl isocyanate

HCID 11160106DE(5-carboxamide)oxcarbazepine

생성물 1

HCID 34312Oxcarbazepine

출처 및 근거

ORD 기록: ord-ad8f3762e3f74d2c9bb35bf5addc2491
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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