Vitas-M small molecule compound

N,N-dibutyl-2-{[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamide

Catalog ID
STK830866
SMILES CCCCN(C(=O)CSc1nnc(o1)c1cc(OC)c(c(c1)OC)OC)CCCC

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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 C21H31N3O5S MW 437.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31N3O5S/c1-6-8-10-24(11-9-7-2)18(25)14-30-21-23-22-20(29-21)15-12-16(26-3)19(28-5)17(13-15)27-4/h12-13H,6-11,14H2,1-5H3
InChIKey
TXXZSJKVKLAVKZ-UHFFFAOYSA-N
Synonyms
336181-29-4
336181294
CCCCN(CCCC)C(=O)CSC1=NN=C(O1)C2=CC(=C(C(=C2)OC)OC)OC
InChI=1SC21H31N3O5Sc1681024(11972)18(25)143021232220(2921)151216(263)19(285)17(1315)274h1213H61114H215H3
MFCD01859427
NNdibutyl2((5(345trimethoxyphenyl)134oxadiazol2yl)sulfanyl)acetamide
NNdibutyl2((5(345trimethoxyphenyl)134oxadiazol2yl)thio)acetamide
ZINC000004338364
ZINC04338364
ZINC4338364

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Available files

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