OTAVA-FLUOR OTVD_0176

pro_cas
pro_cdbregno
CCD00911631
pro_formula
C25 H27 N2 S . Cl O4
pro_molWeight
487.017

basic_info

Product_Name: OTAVA-FLUOR OTVD_0176
EnglishSynonyms: OTAVA-FLUOR OTVD_0176
pro_mdlNumber: MFCD10001139
pro_acceptors: 2
pro_donors: 0
pro_smile: CC[n+]1c(csc1/C=C/C=C/2\C(c3ccccc3N2C)(C)C)c4ccccc4.[O-]Cl(=O)(=O)=O
InChi: InChI=1S/C25H27N2S.ClHO4/c1-5-27-22(19-12-7-6-8-13-19)18-28-24(27)17-11-16-23-25(2,3)20-14-9-10-15-21(20)26(23)4;2-1(3,4)5/h6-18H,5H2,1-4H3;(H,2,3,4,5)/q+1;/p-1
InChiKey: InChIKey=RMOKFHIGPWOJDB-UHFFFAOYSA-M

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