Vitas-M small molecule compound
3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-7-[(pentafluorobenzyl)oxy]-2H-chromen-2-one
Catalog ID
STK539613
SMILES Brc1ccc(cc1)c1csc(n1)c1cc2ccc(cc2oc1=O)OCc1c(F)c(F)c(c(c1F)F)F
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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 C25H11BrF5NO3S MW 580.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H11BrF5NO3S/c26-13-4-1-11(2-5-13)17-10-36-24(32-17)15-7-12-3-6-14(8-18(12)35-25(15)33)34-9-16-19(27)21(29)23(31)22(30)20(16)28/h1-8,10H,9H2InChIKey
NEVYKTPWJDHZFD-UHFFFAOYSA-NSynonyms
3(4(4bromophenyl)13thiazol2yl)7((23456pentafluorophenyl)methoxy)chromen2one
3(4(4bromophenyl)13thiazol2yl)7((pentafluorobenzyl)oxy)2Hchromen2one
3(4(4bromophenyl)thiazol2yl)7((perfluorophenyl)methoxy)2Hchromen2one
C1=CC(=CC=C1C2=CSC(=N2)C3=CC4=C(C=C(C=C4)OCC5=C(C(=C(C(=C5F)F)F)F)F)OC3=O)Br
InChI=1SC25H11BrF5NO3Sc26134111(2513)17103624(3217)157123614(818(12)3525(15)33)3491619(27)21(29)23(31)22(30)20(16)28h1810H9H2
MFCD02167184
ZINC000001799149
ZINC01799149
ZINC1799149
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