Bicarbonate Ion → 2-Tert-butyl-6-isothiocyanato-5-(4-methyl-piperazin-1-yl)benzothiazole

HRID 193425

반응식

HRID 193425 반응식
[C:22](=[O:23])([OH:24])[O-:25].[CH:33]([Cl:34])([Cl:35])[Cl:36].[Cl:27][C:28]([Cl:29])=[S:30].[NH2:1][c:2]1[cH:3][c:4]2[c:5]([n:6][c:7]([C:9]([CH3:10])([CH3:11])[CH3:12])[s:8]2)[cH:13][c:14]1[N:15]1[CH2:16][CH2:17][N:18]([CH3:21])[CH2:19][CH2:20]1.[Na+:26].[Na+:32].[OH-:31].[OH2:37]>>[N:1]([c:2]1[cH:3][c:4]2[c:5]([n:6][c:7]([C:9]([CH3:10])([CH3:11])[CH3:12])[s:8]2)[cH:13][c:14]1[N:15]1[CH2:16][CH2:17][N:18]([CH3:21])[CH2:19][CH2:20]1)=[C:28]=[S:30]

참가 물질

8

출처 및 근거

ORD 기록
ord-e76af23c225141ad82a57af9645fe93b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

불러오는 중…