Vitas-M small molecule compound

(2Z)-2-(biphenyl-4-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-methoxybenzenesulfonate

Catalog ID
STK992474
SMILES COc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)c1ccccc1)/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 C28H20O6S MW 484.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20O6S/c1-32-22-11-14-24(15-12-22)35(30,31)34-23-13-16-25-26(18-23)33-27(28(25)29)17-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-18H,1H3/b27-17-
InChIKey
KQDWROHJJMKIBL-PKAZHMFMSA-N
Synonyms
929413-77-4
((2Z)3oxo2((4phenylphenyl)methylidene)1benzofuran6yl)4methoxybenzenesulfonate
(2Z)2(biphenyl4ylmethylidene)3oxo23dihydro1benzofuran6yl4methoxybenzenesulfonate
(Z)2((11biphenyl)4ylmethylene)3oxo23dihydrobenzofuran6yl4methoxybenzenesulfonate
3OXO2((4PHENYLPHENYL)METHYLENE)BENZO(34B)FURAN6YL4METHOXYBENZENESULFONATE
929413774
COC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC=C(C=C4)C5=CC=CC=C5)O3
COc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)OC(=Cc1ccc(cc1)c1ccccc1)C2=O
InChI=1SC28H20O6Sc13222111424(151222)35(3031)342313162526(1823)3327(28(25)29)17197921(10819)205324620h218H1H3b2717
MFCD09844236
ZINC000009420946
ZINC09420946
ZINC9420946

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Available files

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