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SMILES: n1(c(nnc1S)c1ccc(cc1)OC)CC=C Canonical SMILES: C=CCn1c(S)nnc1c1ccc(cc1)OC InChI: InChI=1S/C12H13N3OS/c1-3-8-15-11(13-14-12(15)17)9-4-6-10(16-2)7-5-9/h3-7H,1,8H2,2H3,(H,14,17) InChIKey: MVQQXNAKPPUALI-UHFFFAOYSA-N
CBID:27844 http://www.chembase.cn/molecule-27844.html