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SMILES: C1CS(=O)c2c(C1(C)C)cc(cc2)C#Cc1ncc(cc1)C(=O)O Canonical SMILES: OC(=O)c1ccc(nc1)C#Cc1ccc2c(c1)C(C)(C)CCS2=O InChI: InChI=1S/C19H17NO3S/c1-19(2)9-10-24(23)17-8-4-13(11-16(17)19)3-6-15-7-5-14(12-20-15)18(21)22/h4-5,7-8,11-12H,9-10H2,1-2H3,(H,21,22) InChIKey: SMCJVZRFBIOWHW-UHFFFAOYSA-N
CBID:178098 http://www.chembase.cn/molecule-178098.html