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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 C19012
pubchemid 124489684
name Pirimiphos-ethyl
formula C13H24N3O3PS
structure
Isomeric_Smiles C[C@H]1CCNC[C@@H]1NS(=O)(=O)C2=C(C=CC(=C2)F)C
Cannoical_Smiles CC1CCNCC1NS(=O)(=O)C2=C(C=CC(=C2)F)C
Gotenzyme_Smiles CCOP(=S)(OCC)Oc1cc(C)nc(N(CC)CC)n1