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SMILES: n1(c(nnc1O)S)C1CCCCC1 Canonical SMILES: Oc1nnc(n1C1CCCCC1)S InChI: InChI=1S/C8H13N3OS/c12-7-9-10-8(13)11(7)6-4-2-1-3-5-6/h6H,1-5H2,(H,9,12)(H,10,13) InChIKey: XLRPFBACBJJYFG-UHFFFAOYSA-N
CBID:101965 http://www.chembase.cn/molecule-101965.html