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SMILES: n1(c(nnc1COc1ccc(cc1)C)S)CC=C Canonical SMILES: C=CCn1c(COc2ccc(cc2)C)nnc1S InChI: InChI=1S/C13H15N3OS/c1-3-8-16-12(14-15-13(16)18)9-17-11-6-4-10(2)5-7-11/h3-7H,1,8-9H2,2H3,(H,15,18) InChIKey: KHPSHDLGIFLKSX-UHFFFAOYSA-N
CBID:27958 http://www.chembase.cn/molecule-27958.html