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MTC 智能计算中心MTC Computing Center AI × 蛋白质与酶工程AI for Protein & Enzyme Engineering

化合物信息

名称 内容
kegg编号 C18468
pubchemid 124489142
name Imibenconazole
formula C17H13Cl3N4S
structure
Isomeric_Smiles COC(=O)[C@]1(CCOC1)N2CCNCC2
Cannoical_Smiles COC(=O)C1(CCOC1)N2CCNCC2
Gotenzyme_Smiles Clc1ccc(CS/C(Cn2cncn2)=N\c2ccc(Cl)cc2Cl)cc1