SAMIXOGREL ,133276-80-9 _ChemCD

SAMIXOGREL

basic_info
Product_Name：	SAMIXOGREL
CAS：	133276-80-9
EnglishSynonyms：	SAMIXOGREL
pro_mdlNumber：	MFCD00866173
pro_acceptors：	6
pro_donors：	2
pro_smile：	c1cc(cnc1)/C(=C/CCCC(=O)O)/c2ccc(cc2)CCNS(=O)(=O)c3ccc(cc3)Cl
InChi：	InChI=1S/C25H25ClN2O4S/c26-22-11-13-23(14-12-22)33(31,32)28-17-15-19-7-9-20(10-8-19)24(5-1-2-6-25(29)30)21-4-3-16-27-18-21/h3-5,7-14,16,18,28H,1-2,6,15,17H2,(H,29,30)/b24-5+
InChiKey：	InChIKey=LGHLGTHRJNIRCA-ZXKDJJQISA-N

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