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SMILES: c1(c2sc(C#CCO)cc2)c(ncn1CCc1nc[nH]c1)c1ccccc1 Canonical SMILES: OCC#Cc1ccc(s1)c1n(cnc1c1ccccc1)CCc1c[nH]cn1 InChI: InChI=1S/C21H18N4OS/c26-12-4-7-18-8-9-19(27-18)21-20(16-5-2-1-3-6-16)24-15-25(21)11-10-17-13-22-14-23-17/h1-3,5-6,8-9,13-15,26H,10-12H2,(H,22,23) InChIKey: YCUGFGSWZFBQCE-UHFFFAOYSA-N
CBID:460304 http://www.chembase.cn/molecule-460304.html