OTAVA-FLUOR OTVD_0276

pro_cas
pro_cdbregno
CCD00911724
pro_formula
C34 H31 N2 S2 . C7 H7 O3 S
pro_molWeight
702.96

basic_info

Product_Name: OTAVA-FLUOR OTVD_0276
EnglishSynonyms: OTAVA-FLUOR OTVD_0276
pro_mdlNumber: MFCD10001232
pro_acceptors: 2
pro_donors: 0
pro_smile: CC[n+]1c2ccc3ccccc3c2sc1/C=C/4\CCCC(=C4)/C=C\5/N(c6ccc7ccccc7c6S5)CC.Cc1ccc(cc1)S(=O)(=O)[O-]
InChi: InChI=1S/C34H31N2S2.C7H8O3S/c1-3-35-29-18-16-25-12-5-7-14-27(25)33(29)37-31(35)21-23-10-9-11-24(20-23)22-32-36(4-2)30-19-17-26-13-6-8-15-28(26)34(30)38-32;1-6-2-4-7(5-3-6)11(8,9)10/h5-8,12-22H,3-4,9-11H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChiKey: InChIKey=JNYHRBCUNIQYED-UHFFFAOYSA-M

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