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SMILES: N1(c2cc(nc(n2)SC)Cl)CCCC1 Canonical SMILES: CSc1nc(cc(n1)Cl)N1CCCC1 InChI: InChI=1S/C9H12ClN3S/c1-14-9-11-7(10)6-8(12-9)13-4-2-3-5-13/h6H,2-5H2,1H3 InChIKey: VVDFPCMQZZEGAD-UHFFFAOYSA-N
CBID:75575 http://www.chembase.cn/molecule-75575.html