OTAVA-FLUOR OTVD_0371

pro_cas
pro_cdbregno
CCD00911786
pro_formula
C29 H35 N2 S2 . Cl O4
pro_molWeight
575.19

basic_info

Product_Name: OTAVA-FLUOR OTVD_0371
EnglishSynonyms: OTAVA-FLUOR OTVD_0371
pro_mdlNumber: MFCD10001324
pro_acceptors: 2
pro_donors: 0
pro_smile: CC[n+]1c2ccccc2sc1/C=C(\CCC3CCCCC3)/C=C\4/N(c5ccccc5S4)CC.[O-]Cl(=O)(=O)=O
InChi: InChI=1S/C29H35N2S2.ClHO4/c1-3-30-24-14-8-10-16-26(24)32-28(30)20-23(19-18-22-12-6-5-7-13-22)21-29-31(4-2)25-15-9-11-17-27(25)33-29;2-1(3,4)5/h8-11,14-17,20-22H,3-7,12-13,18-19H2,1-2H3;(H,2,3,4,5)/q+1;/p-1
InChiKey: InChIKey=JQNZVBKQJGHYOC-UHFFFAOYSA-M

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