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SMILES: [Na].O.N12[C@H](SC([C@@H]1C(=O)O)(C)C)[C@@H](C2=O)NC(=O)c1c(onc1c1c(cccc1Cl)Cl)C Canonical SMILES: OC(=O)[C@@H]1N2C(=O)[C@H]([C@H]2SC1(C)C)NC(=O)c1c(C)onc1c1c(Cl)cccc1Cl.O.[Na] InChI: InChI=1S/C19H17Cl2N3O5S.Na.H2O/c1-7-10(12(23-29-7)11-8(20)5-4-6-9(11)21)15(25)22-13-16(26)24-14(18(27)28)19(2,3)30-17(13)24;;/h4-6,13-14,17H,1-3H3,(H,22,25)(H,27,28);;1H2/t13-,14+,17-;;/m1../s1 InChIKey: QBFCIKYALGTFHK-VICXVTCVSA-N
CBID:167176 http://www.chembase.cn/molecule-167176.html