Vitas-M small molecule compound

(2Z)-3-oxo-2-[(2E)-3-phenylprop-2-en-1-ylidene]-2,3-dihydro-1-benzofuran-6-yl 4-methylbenzenesulfonate

Catalog ID
STK656332
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\C=C\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 C24H18O5S MW 418.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18O5S/c1-17-10-13-20(14-11-17)30(26,27)29-19-12-15-21-23(16-19)28-22(24(21)25)9-5-8-18-6-3-2-4-7-18/h2-16H,1H3/b8-5+,22-9-
InChIKey
VMUAJJOCDQHSFV-UPFJJGCZSA-N
Synonyms
929434-32-2
((2Z)3oxo2((E)3phenylprop2enylidene)1benzofuran6yl)4methylbenzenesulfonate
(2Z)3oxo2((2E)3phenylprop2en1ylidene)23dihydro1benzofuran6yl4methylbenzenesulfonate
(Z)3oxo2((E)3phenylallylidene)23dihydrobenzofuran6yl4methylbenzenesulfonate
2((2E)3PHENYLPROP2ENYLIDENE)3OXOBENZO(34B)FURAN6YL4METHYLBENZENESULFONATE
929434322
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C(=O)C(=CC=CC4=CC=CC=C4)O3
Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)OC(=CC=Cc1ccccc1)C2=O
InChI=1SC24H18O5Sc117101320(141117)30(2627)291912152123(1619)2822(24(21)25)958186324718h216H1H3b85+229
MFCD09844097
ZINC000009420629
ZINC09420629
ZINC9420629

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Available files

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