Vitas-M small molecule compound
1,1-dioxido-3-(phenylcarbonyl)-2-(prop-2-en-1-yl)-2H-1,2-benzothiazin-4-yl 4-methoxybenzoate
Catalog ID
STK859998
SMILES C=CCN1C(=C(OC(=O)c2ccc(cc2)OC)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)18-9-5-4-6-10-18)25(21-11-7-8-12-22(21)34(27,30)31)33-26(29)19-13-15-20(32-2)16-14-19/h3-16H,1,17H2,2H3InChIKey
HFDWBHUFCXEJSM-UHFFFAOYSA-NSynonyms
578733-72-9(3benzoyl11dioxo2prop2enyl1$l^(6)2benzothiazin4yl)4methoxybenzoate
11dioxido3(phenylcarbonyl)2(prop2en1yl)2H12benzothiazin4yl4methoxybenzoate
2allyl3benzoyl11dioxido2Hbenzo(e)(12)thiazin4yl4methoxybenzoate
3BENZOYL11DIOXIDO2(PROP2EN1YL)2H12BENZOTHIAZIN4YL4METHOXYBENZOATE
578733729
COC1=CC=C(C=C1)C(=O)OC2=C(N(S(=O)(=O)C3=CC=CC=C32)CC=C)C(=O)C4=CC=CC=C4
InChI=1SC26H21NO6Sc13172723(24(28)1895461018)25(2111781222(21)34(2730)31)3326(29)19131520(322)161419h316H117H22H3
MFCD04031565
ZINC000002478112
ZINC02478112
ZINC2478112
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