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SMILES: n1(c(nnc1S)c1ccc(cc1)C(C)C)CC=C Canonical SMILES: C=CCn1c(S)nnc1c1ccc(cc1)C(C)C InChI: InChI=1S/C14H17N3S/c1-4-9-17-13(15-16-14(17)18)12-7-5-11(6-8-12)10(2)3/h4-8,10H,1,9H2,2-3H3,(H,16,18) InChIKey: PNTLJYXWEGOQAV-UHFFFAOYSA-N
CBID:27903 http://www.chembase.cn/molecule-27903.html