Vitas-M small molecule compound
(4E)-6-(4,6-dimethoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-N-[(2Z)-4,5,6,7-tetrahydro-1,3-benzothiazol-2(3H)-ylidene]hex-4-enamide
Catalog ID
STL520491
SMILES COc1c(C/C=C(/CCC(=O)/N=c\2/[nH]c3c(s2)CCCC3)\C)c(OC)c2c(c1C)COC2=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 C25H30N2O5S MW 470.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O5S/c1-14(10-12-20(28)27-25-26-18-7-5-6-8-19(18)33-25)9-11-16-22(30-3)15(2)17-13-32-24(29)21(17)23(16)31-4/h9H,5-8,10-13H2,1-4H3,(H,26,27,28)/b14-9+InChIKey
WKNFOUUQKGUGRC-NTEUORMPSA-NSynonyms
1282457-73-1(~(E))6(46dimethoxy7methyl3oxo1~(H)2benzofuran5yl)4methyl~(N)(4567tetrahydro13benzothiazol2yl)hex4enamide
(4E)6(46dimethoxy7methyl3oxo13dihydro2benzofuran5yl)4methylN((2Z)4567tetrahydro13benzothiazol2(3H)ylidene)hex4enamide
1282457731
52905477
InChI=1SC25H30N2O5Sc114(101220(28)27252618756819(18)3325)9111622(303)15(2)17133224(29)21(17)23(16)314h9H581013H214H3(H262728)b149+
MFCD31752245
ZINC000062001693
ZINC62001693
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