Vitas-M small molecule compound

4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one

Catalog ID
STK820128
SMILES CCOc1cc(ccc1OCCC(C)C)C1N(c2sc3c(n2)c(C)cc(c3)C)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)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 C35H36N2O7S MW 628.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H36N2O7S/c1-6-41-26-17-22(7-9-24(26)42-12-11-19(2)3)31-29(32(38)23-8-10-25-27(18-23)44-14-13-43-25)33(39)34(40)37(31)35-36-30-21(5)15-20(4)16-28(30)45-35/h7-10,15-19,31,39H,6,11-14H2,1-5H3
InChIKey
XFXBPYNQAKCALO-UHFFFAOYSA-N
Synonyms

4(23dihydro14benzodioxin6ylcarbonyl)1(46dimethyl13benzothiazol2yl)5(3ethoxy4(3methylbutoxy)phenyl)3hydroxy15dihydro2Hpyrrol2one
4(23dihydrobenzo(b)(14)dioxine6carbonyl)1(46dimethylbenzo(d)thiazol2yl)5(3ethoxy4(isopentyloxy)phenyl)3hydroxy1Hpyrrol2(5H)one
MFCD04575908
ZINC000097967634
ZINC000097967635

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Available files

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