OTAVA-FLUOR OTVD_0281_Chemical Cloud Database

OTAVA-FLUOR OTVD_0281

Basic Information
Product Name：	OTAVA-FLUOR OTVD_0281
English Synonyms：	OTAVA-FLUOR OTVD_0281
MDL Number.：	MFCD10001243
H bond acceptor：	4
H bond donor：	0
Smile：	CC[n+]1c2cc(ccc2n(c1/C=C/C=C/C=C/3\N(c4ccccc4S3)CC)c5ccccc5)c6nc7ccccc7s6.[I-]
InChi：	InChI=1S/C36H31N4S2.HI/c1-3-38-31-25-26(36-37-28-17-11-13-19-32(28)42-36)23-24-29(31)40(27-15-7-5-8-16-27)34(38)21-9-6-10-22-35-39(4-2)30-18-12-14-20-33(30)41-35;/h5-25H,3-4H2,1-2H3;1H/q+1;/p-1
InChiKey：	InChIKey=XINIPLBMZBHSRM-UHFFFAOYSA-M

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