Vitas-M small molecule compound

1,1-dioxido-3-(phenylcarbonyl)-2-(prop-2-en-1-yl)-2H-1,2-benzothiazin-4-yl 2-methoxybenzoate

Catalog ID
STK860003
SMILES C=CCN1C(=C(OC(=O)c2ccccc2OC)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 C26H21NO6S MW 475.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21NO6S/c1-3-17-27-23(24(28)18-11-5-4-6-12-18)25(20-14-8-10-16-22(20)34(27,30)31)33-26(29)19-13-7-9-15-21(19)32-2/h3-16H,1,17H2,2H3
InChIKey
MYEPAFPUOOKHPX-UHFFFAOYSA-N
Synonyms
841207-42-9
(3benzoyl11dioxo2prop2enyl1$l^(6)2benzothiazin4yl)2methoxybenzoate
11dioxido3(phenylcarbonyl)2(prop2en1yl)2H12benzothiazin4yl2methoxybenzoate
2allyl3benzoyl11dioxido2Hbenzo(e)(12)thiazin4yl2methoxybenzoate
841207429
COC1=CC=CC=C1C(=O)OC2=C(N(S(=O)(=O)C3=CC=CC=C32)CC=C)C(=O)C4=CC=CC=C4
InChI=1SC26H21NO6Sc13172723(24(28)18115461218)25(20148101622(20)34(2730)31)3326(29)1913791521(19)322h316H117H22H3
MFCD04011348
ZINC000001410051
ZINC01410051
ZINC1410051

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Available files

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