Vitas-M small molecule compound
4,5-bis[(4-tert-butylphenyl)sulfanyl]-3,6-difluorobenzene-1,2-dicarbonitrile
Catalog ID
STL323903
SMILES N#Cc1c(F)c(Sc2ccc(cc2)C(C)(C)C)c(c(c1C#N)F)Sc1ccc(cc1)C(C)(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H26F2N2S2 MW 492.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26F2N2S2/c1-27(2,3)17-7-11-19(12-8-17)33-25-23(29)21(15-31)22(16-32)24(30)26(25)34-20-13-9-18(10-14-20)28(4,5)6/h7-14H,1-6H3InChIKey
LWYOSJKZMMIZKR-UHFFFAOYSA-NSynonyms
121933-24-2121933242
45bis((4(tertbutyl)phenyl)thio)36difluorophthalonitrile
45bis((4tertbutylphenyl)sulfanyl)36difluorobenzene12dicarbonitrile
CC(C)(C)C1=CC=C(C=C1)SC2=C(C(=C(C(=C2SC3=CC=C(C=C3)C(C)(C)C)F)C#N)C#N)F
InChI=1SC28H26F2N2S2c127(23)1771119(12817)332523(29)21(1531)22(1632)24(30)26(25)342013918(101420)28(45)6h714H16H3
MFCD01087941
ZINC000002371870
ZINC02371870
ZINC2371870
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