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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 C14838
pubchemid 17395836
name Y 23684
formula C18H13ClN2O2S
structure
Isomeric_Smiles CC1CCCCC12C(=O)N(C(=O)N2)CC(=O)NC3=NC4=CC=CC=C4S3
Cannoical_Smiles CC1CCCCC12C(=O)N(C(=O)N2)CC(=O)NC3=NC4=CC=CC=C4S3
Gotenzyme_Smiles O=c1cc2c(nn1-c1ccc(Cl)cc1)-c1ccccc1S(=O)CC2