Vitas-M small molecule compound

ethyl 4-({[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl}amino)benzoate

Catalog ID
STK841988
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(o1)CSc1nc(C)cc(n1)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 C20H21N5O4S2 MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O4S2/c1-4-28-18(27)14-5-7-15(8-6-14)23-16(26)10-31-20-25-24-17(29-20)11-30-19-21-12(2)9-13(3)22-19/h5-9H,4,10-11H2,1-3H3,(H,23,26)
InChIKey
PUEOLSNTGKAAKB-UHFFFAOYSA-N
Synonyms
494825-95-5
494825955
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(O2)CSC3=NC(=CC(=N3)C)C
ethyl4((((5(((46dimethylpyrimidin2yl)sulfanyl)methyl)134oxadiazol2yl)sulfanyl)acetyl)amino)benzoate
ETHYL4((2((5((46DIMETHYLPYRIMIDIN2YL)SULFANYLMETHYL)134OXADIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
ethyl4(2((5(((46dimethylpyrimidin2yl)thio)methyl)134oxadiazol2yl)thio)acetamido)benzoate
ETHYL4(2(5((46DIMETHYLPYRIMIDIN2YLTHIO)METHYL)134OXADIAZOL2YLTHIO)ACETYLAMINO)BENZOATE
InChI=1SC20H21N5O4S2c142818(27)145715(8614)2316(26)103120252417(2920)1130192112(2)913(3)2219h59H41011H213H3(H2326)
MFCD03269003
ZINC000002351781
ZINC02351781
ZINC2351781

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Available files

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