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SMILES: c1(N2C[C@H]3C(=O)N([C@@H](C2)CC3)CCOC)c2c(nc(n1)C)scc2 Canonical SMILES: COCCN1[C@@H]2CC[C@H](C1=O)CN(C2)c1nc(C)nc2c1ccs2 InChI: InChI=1S/C17H22N4O2S/c1-11-18-15(14-5-8-24-16(14)19-11)20-9-12-3-4-13(10-20)21(17(12)22)6-7-23-2/h5,8,12-13H,3-4,6-7,9-10H2,1-2H3/t12-,13+/m0/s1 InChIKey: SQFRLOHTTSQSJU-QWHCGFSZSA-N
CBID:350345 http://www.chembase.cn/molecule-350345.html