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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 C19044
pubchemid 124489716
name Benzoylprop-ethyl
formula C18H17Cl2NO3
structure
Isomeric_Smiles C[C@H]1CCNC[C@H]1NS(=O)(=O)C2=CN(C(=N2)C)C
Cannoical_Smiles CC1CCNCC1NS(=O)(=O)C2=CN(C(=N2)C)C
Gotenzyme_Smiles CCOC(=O)C(C)N(C(=O)c1ccccc1)c1ccc(Cl)c(Cl)c1