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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 C12685
pubchemid 583075
name Cyclothiazide
formula C14H16ClN3O4S2
structure
Isomeric_Smiles CCCCCCCCCCCCC1=CC2=C(CCC2)C=C1
Cannoical_Smiles CCCCCCCCCCCCC1=CC2=C(CCC2)C=C1
Gotenzyme_Smiles NS(=O)(=O)c1cc2c(cc1Cl)NC(C1CC3C=CC1C3)NS2(=O)=O