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SMILES: n1(c(nnc1S)C(Oc1ccccc1)C)CC=C Canonical SMILES: C=CCn1c(nnc1S)C(Oc1ccccc1)C InChI: InChI=1S/C13H15N3OS/c1-3-9-16-12(14-15-13(16)18)10(2)17-11-7-5-4-6-8-11/h3-8,10H,1,9H2,2H3,(H,15,18) InChIKey: OHROLIMVKIAXAR-UHFFFAOYSA-N
CBID:28006 http://www.chembase.cn/molecule-28006.html