Vitas-M small molecule compound
N,N'-[(1,1,1,3,3,3-hexafluoropropane-2,2-diyl)bis(2-hydroxybenzene-4,1-diyl)]bis[2-(pyridin-2-ylsulfanyl)acetamide]
Catalog ID
STK346131
SMILES O=C(Nc1ccc(cc1O)C(C(F)(F)F)(C(F)(F)F)c1ccc(c(c1)O)NC(=O)CSc1ccccn1)CSc1ccccn1
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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 C29H22F6N4O4S2 MW 668.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22F6N4O4S2/c30-28(31,32)27(29(33,34)35,17-7-9-19(21(40)13-17)38-23(42)15-44-25-5-1-3-11-36-25)18-8-10-20(22(41)14-18)39-24(43)16-45-26-6-2-4-12-37-26/h1-14,40-41H,15-16H2,(H,38,42)(H,39,43)InChIKey
PEHDRKOABOQZSJ-UHFFFAOYSA-NSynonyms
C1=CC=NC(=C1)SCC(=O)NC2=C(C=C(C=C2)C(C3=CC(=C(C=C3)NC(=O)CSC4=CC=CC=N4)O)(C(F)(F)F)C(F)(F)F)O
InChI=1SC29H22F6N4O4S2c3028(3132)27(29(3334)35177919(21(40)1317)3823(42)154425513113625)1881020(22(41)1418)3924(43)164526624123726h1144041H1516H2(H3842)(H3943)
MFCD07160320
N(4(111333hexafluoro2(3hydroxy4((2pyridin2ylsulfanylacetyl)amino)phenyl)propan2yl)2hydroxyphenyl)2pyridin2ylsulfanylacetamide
NN((111333hexafluoropropane22diyl)bis(2hydroxybenzene41diyl))bis(2(pyridin2ylsulfanyl)acetamide)
ZINC000150429806
ZINC150429806
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