Hydrochloric Acid → HCID 178446098, 화합물

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[Cl:1][C:2]1=[N:3][S:4](=[O:11])(=[O:12])[c:5]2[c:6]1[cH:7][cH:8][cH:9][cH:10]2.[ClH:13].[ClH:14].[NH2:15][CH:16]([C:17](=[O:18])[NH:19][C:20]1([C:30]#[N:31])[CH2:21][N:22]([CH:25]([CH2:26][CH3:27])[CH2:28][CH3:29])[CH2:23][CH2:24]1)[CH2:32][CH:33]1[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38]1>>[C:2]1([NH:15][CH:16]([C:17](=[O:18])[NH:19][C:20]2([C:30]#[N:31])[CH2:21][N:22]([CH:25]([CH2:26][CH3:27])[CH2:28][CH3:29])[CH2:23][CH2:24]2)[CH2:32][CH:33]2[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38]2)=[N:3][S:4](=[O:11])(=[O:12])[c:5]2[c:6]1[cH:7][cH:8][cH:9][cH:10]2

참가 물질

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HCID 313Hydrochloric Acid2회

HCID 64783Pseudosaccharin chloride

HCID 220632822-amino-N-(3-cyano-1-pentan-3-ylpyrrolidin-3-yl)-3-cyclohexylpropanamide

생성물 1

HCID 178446098HCID 178446098, 화합물

출처 및 근거

ORD 기록: ord-a638ba1c48984a1c877da1d1034ead89
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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