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SMILES: n1(c(=O)c2c(nc1)cccc2)CC(=O)NCCSc1n(ccn1)C Canonical SMILES: O=C(Cn1cnc2c(c1=O)cccc2)NCCSc1nccn1C InChI: InChI=1S/C16H17N5O2S/c1-20-8-6-18-16(20)24-9-7-17-14(22)10-21-11-19-13-5-3-2-4-12(13)15(21)23/h2-6,8,11H,7,9-10H2,1H3,(H,17,22) InChIKey: XTOUVLVRGDQSBX-UHFFFAOYSA-N
CBID:320120 http://www.chembase.cn/molecule-320120.html