Vitas-M small molecule compound
1,1-dioxido-3-(phenylcarbonyl)-2-(prop-2-en-1-yl)-2H-1,2-benzothiazin-4-yl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
Catalog ID
STK860005
SMILES C=CCN1C(=C(OC(=O)CN2C(=O)c3c(C2=O)cccc3)c2c(S1(=O)=O)cccc2)C(=O)c1ccccc1
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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 C28H20N2O7S MW 528.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20N2O7S/c1-2-16-30-24(25(32)18-10-4-3-5-11-18)26(21-14-8-9-15-22(21)38(30,35)36)37-23(31)17-29-27(33)19-12-6-7-13-20(19)28(29)34/h2-15H,1,16-17H2InChIKey
AOEMEQYXFOHLCV-UHFFFAOYSA-NSynonyms
577961-49-0(3benzoyl11dioxo2prop2enyl1$l^(6)2benzothiazin4yl)2(13dioxoisoindol2yl)acetate
11dioxido3(phenylcarbonyl)2(prop2en1yl)2H12benzothiazin4yl(13dioxo13dihydro2Hisoindol2yl)acetate
2allyl3benzoyl11dioxido2Hbenzo(e)(12)thiazin4yl2(13dioxoisoindolin2yl)acetate
577961490
C=CCN1C(=C(C2=CC=CC=C2S1(=O)=O)OC(=O)CN3C(=O)C4=CC=CC=C4C3=O)C(=O)C5=CC=CC=C5
InChI=1SC28H20N2O7Sc12163024(25(32)18104351118)26(2114891522(21)38(3035)36)3723(31)172927(33)1912671320(19)28(29)34h215H11617H2
MFCD04028635
ZINC000002384915
ZINC2384915
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