Methanesulfonic Acid → HCID 178436120, 화합물

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[C:6]([CH3:7])([CH3:8])([CH3:9])[O:10][C:11](=[O:12])[N:13]1[CH:14]([C:23]([NH:24][C:25]2([C:28]#[N:29])[CH2:26][CH2:27]2)=[O:30])[CH2:15][CH:16]([O:18][S:19]([CH3:20])(=[O:21])=[O:22])[CH2:17]1.[CH2:31]([CH3:32])[c:33]1[c:34]([SH:39])[cH:35][cH:36][cH:37][cH:38]1.[CH3:1][S:2]([OH:3])(=[O:4])=[O:5]>>[C:6]([CH3:7])([CH3:8])([CH3:9])[O:10][C:11](=[O:12])[N:13]1[CH:14]([C:23]([NH:24][C:25]2([C:28]#[N:29])[CH2:26][CH2:27]2)=[O:30])[CH2:15][CH:16]([S:39][c:34]2[c:33]([CH2:31][CH3:32])[cH:38][cH:37][cH:36][cH:35]2)[CH2:17]1

참가 물질

반응물 3

HCID 6395Methanesulfonic Acid

HCID 37343382-Ethylbenzenethiol

HCID 178452484CID 72322184

생성물 1

HCID 178436120HCID 178436120, 화합물

출처 및 근거

ORD 기록: ord-1ca141326fe148099a41362fae42a54d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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