Vitas-M small molecule compound

(2Z)-2-(2-chloro-6-fluorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3,4,5-trimethoxybenzoate

Catalog ID
STK923677
SMILES COc1c(OC)cc(cc1OC)C(=O)Oc1ccc2c(c1)O/C(=C\c1c(F)cccc1Cl)/C2=O

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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 C25H18ClFO7 MW 484.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClFO7/c1-30-21-9-13(10-22(31-2)24(21)32-3)25(29)33-14-7-8-15-19(11-14)34-20(23(15)28)12-16-17(26)5-4-6-18(16)27/h4-12H,1-3H3/b20-12-
InChIKey
DJIRXQIYKNYIBY-NDENLUEZSA-N
Synonyms
846584-61-0
((2Z)2((2CHLORO6FLUOROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)345TRIMETHOXYBENZOATE
(2Z)2(2chloro6fluorobenzylidene)3oxo23dihydro1benzofuran6yl345trimethoxybenzoate
(Z)2(2chloro6fluorobenzylidene)3oxo23dihydrobenzofuran6yl345trimethoxybenzoate
2((6CHLORO2FLUOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL345TRIMETHOXYBENZOATE
846584610
COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=C(C=CC=C4Cl)F)O3
COc1c(OC)cc(cc1OC)C(=O)Oc1ccc2c(c1)OC(=Cc1c(F)cccc1Cl)C2=O
InChI=1SC25H18ClFO7c13021913(1022(312)24(21)323)25(29)3314781519(1114)3420(23(15)28)121617(26)54618(16)27h412H13H3b2012
MFCD04175513
ZINC000011868757
ZINC11868757

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Available files

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