Vitas-M small molecule compound
(4Z)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-ylidene]-2-(4-methoxyphenyl)-1,3-oxazol-5(4H)-one
Catalog ID
STL241849
SMILES COc1ccc(cc1)C1=N/C(=C\2/C=C(Oc3c2cccc3)c2ccc3c(c2)OCCO3)/C(=O)O1
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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 C27H19NO6 MW 453.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19NO6/c1-30-18-9-6-16(7-10-18)26-28-25(27(29)34-26)20-15-23(33-21-5-3-2-4-19(20)21)17-8-11-22-24(14-17)32-13-12-31-22/h2-11,14-15H,12-13H2,1H3/b25-20-InChIKey
KQKCVXVGVPDEFF-QQTULTPQSA-NSynonyms
929870-69-9(4Z)4(2(23dihydro14benzodioxin6yl)4Hchromen4ylidene)2(4methoxyphenyl)13oxazol5(4H)one
(4Z)4(2(23dihydro14benzodioxin6yl)chromen4ylidene)2(4methoxyphenyl)13oxazol5one
(Z)4(2(23dihydrobenzo(b)(14)dioxin6yl)4Hchromen4ylidene)2(4methoxyphenyl)oxazol5(4H)one
929870699
COC1=CC=C(C=C1)C2=NC(=C3C=C(OC4=CC=CC=C43)C5=CC6=C(C=C5)OCCO6)C(=O)O2
COc1ccc(cc1)C1=NC(=C2C=C(Oc3c2cccc3)c2ccc3c(c2)OCCO3)C(=O)O1
InChI=1SC27H19NO6c130189616(71018)262825(27(29)3426)201523(3321532419(20)21)178112224(1417)3213123122h2111415H1213H21H3b2520
MFCD08748572
ZINC000009341416
ZINC09341416
ZINC9341416
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