Vitas-M small molecule compound
(2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl thiophene-2-carboxylate
Catalog ID
STK992980
SMILES Clc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OC(=O)c2cccs2)c2c(c1)COCO2
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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 C22H13ClO6S MW 440.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13ClO6S/c23-14-6-12(21-13(7-14)10-26-11-27-21)8-18-20(24)16-4-3-15(9-17(16)29-18)28-22(25)19-2-1-5-30-19/h1-9H,10-11H2/b18-8-InChIKey
WAXGYPVOTDROEF-LSCVHKIXSA-NSynonyms
929511-39-7((2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo1benzofuran6yl)thiophene2carboxylate
(2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo23dihydro1benzofuran6ylthiophene2carboxylate
(Z)2((6chloro4Hbenzo(d)(13)dioxin8yl)methylene)3oxo23dihydrobenzofuran6ylthiophene2carboxylate
2((6CHLORO(2H4HBENZO(E)13DIOXAN8YL))METHYLENE)3OXOBENZO(34B)FURAN6YLTHIOPHENE2CARBOXYLATE
929511397
C1C2=C(C(=CC(=C2)Cl)C=C3C(=O)C4=C(O3)C=C(C=C4)OC(=O)C5=CC=CS5)OCO1
Clc1cc(C=C2Oc3c(C2=O)ccc(c3)OC(=O)c2cccs2)c2c(c1)COCO2
InChI=1SC22H13ClO6Sc2314612(2113(714)1026112721)81820(24)164315(917(16)2918)2822(25)192153019h19H1011H2b188
MFCD09848574
ZINC000009047256
ZINC09047256
ZINC9047256
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