Vitas-M small molecule compound

(4E)-2-(2-chloro-4,5-difluorophenyl)-4-{3-ethoxy-5-iodo-4-[(2-methylbenzyl)oxy]benzylidene}-1,3-oxazol-5(4H)-one

Catalog ID
STL171343
SMILES CCOc1cc(/C=C\2/N=C(OC2=O)c2cc(F)c(cc2Cl)F)cc(c1OCc1ccccc1C)I

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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 C26H19ClF2INO4 MW 609.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19ClF2INO4/c1-3-33-23-10-15(8-21(30)24(23)34-13-16-7-5-4-6-14(16)2)9-22-26(32)35-25(31-22)17-11-19(28)20(29)12-18(17)27/h4-12H,3,13H2,1-2H3/b22-9+
InChIKey
KCQCHCNDLBNULV-LSFURLLWSA-N
Synonyms
352677-44-2
(4E)2(2CHLORO45DIFLUOROPHENYL)4((3ETHOXY5IODO4((2METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)13OXAZOL5ONE
(4E)2(2chloro45difluorophenyl)4(3ethoxy5iodo4((2methylbenzyl)oxy)benzylidene)13oxazol5(4H)one
2(2CHLORO45DIFLUOROPHENYL)4(3ETHOXY5IODO4((2METHYLBENZYL)OXY)BENZYLIDENE)13OXAZOL5(4H)ONE
352677442
CCOC1=C(C(=CC(=C1)C=C2C(=O)OC(=N2)C3=CC(=C(C=C3Cl)F)F)I)OCC4=CC=CC=C4C
CCOc1cc(C=C2N=C(OC2=O)c2cc(F)c(cc2Cl)F)cc(c1OCc1ccccc1C)I
InChI=1SC26H19ClF2INO4c1333231015(821(30)24(23)341316754614(16)2)92226(32)3525(3122)171119(28)20(29)1218(17)27h412H313H212H3b229+
MFCD01834377
ZINC000008396825
ZINC08396825
ZINC8396825

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Available files

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