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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 C18576
pubchemid 124489250
name Clofentezine
formula C14H8Cl2N4
structure
Isomeric_Smiles CCC1=C(SC=C1)C(=O)N2CC[C@H](C2)CNC
Cannoical_Smiles CCC1=C(SC=C1)C(=O)N2CCC(C2)CNC
Gotenzyme_Smiles Clc1ccccc1-c1nnc(-c2ccccc2Cl)nn1