OTAVA-FLUOR OTVD_0372

CAS No.
CCD No.
CCD00911787
Formula
C27 H25 N2 S2 . Cl O4
MolWeight
541.089

Basic Information

Product Name: OTAVA-FLUOR OTVD_0372
English Synonyms: OTAVA-FLUOR OTVD_0372
MDL Number.: MFCD10001325
H bond acceptor: 2
H bond donor: 0
Smile: CC[n+]1c2cc(ccc2sc1/C=C(\C)/C=C\3/N(c4ccccc4S3)C)c5ccccc5.[O-]Cl(=O)(=O)=O
InChi: InChI=1S/C27H25N2S2.ClHO4/c1-4-29-23-18-21(20-10-6-5-7-11-20)14-15-25(23)31-27(29)17-19(2)16-26-28(3)22-12-8-9-13-24(22)30-26;2-1(3,4)5/h5-18H,4H2,1-3H3;(H,2,3,4,5)/q+1;/p-1
InChiKey: InChIKey=YEHGFLYIBYNWFL-UHFFFAOYSA-M

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