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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 C18460
pubchemid 124489134
name Echlomezole
formula C5H5Cl3N2OS
structure
Isomeric_Smiles CC1=NC(=NO1)[C@H](C2=CC=CC=C2OC)NC(=O)C3=CN=NS3
Cannoical_Smiles CC1=NC(=NO1)C(C2=CC=CC=C2OC)NC(=O)C3=CN=NS3
Gotenzyme_Smiles CCOc1nc(C(Cl)(Cl)Cl)ns1