Vitas-M small molecule compound
ethyl 2-{[(4,4-dioxido-3-phenyl-5,6-dihydro-1,4-oxathiin-2-yl)carbonyl]amino}-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK650771
SMILES CCOC(=O)c1c(NC(=O)C2=C(c3ccccc3)S(=O)(=O)CCO2)sc(c1C)C
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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 C20H21NO6S2 MW 435.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO6S2/c1-4-26-20(23)15-12(2)13(3)28-19(15)21-18(22)16-17(14-8-6-5-7-9-14)29(24,25)11-10-27-16/h5-9H,4,10-11H2,1-3H3,(H,21,22)InChIKey
SDFRGPRAFCBGQU-UHFFFAOYSA-NSynonyms
1144458-66-11144458661
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=C(S(=O)(=O)CCO2)C3=CC=CC=C3
ethyl2(((44dioxido3phenyl56dihydro14oxathiin2yl)carbonyl)amino)45dimethylthiophene3carboxylate
ethyl2((44dioxo5phenyl23dihydro14oxathiine6carbonyl)amino)45dimethylthiophene3carboxylate
ethyl2(44dioxido3phenyl56dihydro14oxathiine2carboxamido)45dimethylthiophene3carboxylate
InChI=1SC20H21NO6S2c142620(23)1512(2)13(3)2819(15)2118(22)1617(148657914)29(2425)11102716h59H41011H213H3(H2122)
MFCD12211191
ZINC000032071164
ZINC32071164
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