Vitas-M small molecule compound

methyl ({2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfanyl)acetate

Catalog ID
STK096511
SMILES COC(=O)CSCC(=O)Nc1cc2OCOc2cc1C(=O)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 C14H15NO6S MW 325.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15NO6S/c1-8(16)9-3-11-12(21-7-20-11)4-10(9)15-13(17)5-22-6-14(18)19-2/h3-4H,5-7H2,1-2H3,(H,15,17)
InChIKey
XPFGAVYFXXTYPA-UHFFFAOYSA-N
Synonyms
523991-79-9
523991799
CC(=O)C1=CC2=C(C=C1NC(=O)CSCC(=O)OC)OCO2
COC(=O)CSCC(=O)Nc1cc2OCOc2cc1C(=O)C
InChI=1SC14H15NO6Sc18(16)931112(2172011)410(9)1513(17)522614(18)192h34H57H212H3(H1517)
METHYL((2((6ACETYL13BENZODIOXOL5YL)AMINO)2OXOETHYL)SULFANYL)ACETATE
methyl2((2((6acetylbenzo(d)(13)dioxol5yl)amino)2oxoethyl)thio)acetate
METHYL2((N(6ACETYL2HBENZO(D)13DIOXOLEN5YL)CARBAMOYL)METHYLTHIO)ACETATE
METHYL2(2((6ACETYL13BENZODIOXOL5YL)AMINO)2OXOETHYL)SULFANYLACETATE
MFCD03488881
STK096511
ZINC000003764957
ZINC03764957
ZINC3764957

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Available files

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