Vitas-M small molecule compound

2-bromo-4-{(Z)-[2-(4-fluorophenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}-6-methoxyphenyl acetate

Catalog ID
STK705633
SMILES COc1cc(cc(c1OC(=O)C)Br)/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)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 C20H13BrFN3O4S MW 490.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrFN3O4S/c1-10(26)29-17-14(21)7-11(8-15(17)28-2)9-16-19(27)25-20(30-16)23-18(24-25)12-3-5-13(22)6-4-12/h3-9H,1-2H3/b16-9-
InChIKey
WSWOXGVWIYCKGP-SXGWCWSVSA-N
Synonyms
618853-73-9
(2BROMO4((Z)(2(4FLUOROPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)6METHOXYPHENYL)ACETATE
(Z)2bromo4((2(4fluorophenyl)6oxothiazolo(32b)(124)triazol5(6H)ylidene)methyl)6methoxyphenylacetate
2bromo4((Z)(2(4fluorophenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)6methoxyphenylacetate
618853739
CC(=O)OC1=C(C=C(C=C1Br)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)F)S2)OC
COc1cc(cc(c1OC(=O)C)Br)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)F
InChI=1SC20H13BrFN3O4Sc110(26)291714(21)711(815(17)282)91619(27)2520(3016)2318(2425)123513(22)6412h39H12H3b169
MFCD04012610
ZINC000002408101
ZINC02408101
ZINC2408101

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Available files

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