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SMILES: N1=C(NC2(C3=C1CCCC3)CCCCC2)S Canonical SMILES: SC1=NC2=C(C3(N1)CCCCC3)CCCC2 InChI: InChI=1S/C13H20N2S/c16-12-14-11-7-3-2-6-10(11)13(15-12)8-4-1-5-9-13/h1-9H2,(H2,14,15,16) InChIKey: BNFUEZMEJGCGKN-UHFFFAOYSA-N
CBID:252085 http://www.chembase.cn/molecule-252085.html