Vitas-M small molecule compound

4-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1-(2-phenylethyl)piperazine-2,6-dione

Catalog ID
STL030986
SMILES CSc1ccc(cc1)c1noc(n1)CN1CC(=O)N(C(=O)C1)CCc1ccccc1

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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 C22H22N4O3S MW 422.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O3S/c1-30-18-9-7-17(8-10-18)22-23-19(29-24-22)13-25-14-20(27)26(21(28)15-25)12-11-16-5-3-2-4-6-16/h2-10H,11-15H2,1H3
InChIKey
PKKDDZJWXBJKHX-UHFFFAOYSA-N
Synonyms

4((3(4(methylsulfanyl)phenyl)124oxadiazol5yl)methyl)1(2phenylethyl)piperazine26dione
4((3(4methylsulfanylphenyl)124oxadiazol5yl)methyl)1(2phenylethyl)piperazine26dione
CSC1=CC=C(C=C1)C2=NOC(=N2)CN3CC(=O)N(C(=O)C3)CCC4=CC=CC=C4
InChI=1SC22H22N4O3Sc130189717(81018)222319(292422)13251420(27)26(21(28)1525)1211165324616h210H1115H21H3
MFCD18191050
ZINC000057427675
ZINC57427675

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.