Vitas-M small molecule compound

dodecyl [(3-cyano-4,6-diphenylpyridin-2-yl)sulfanyl]acetate

Catalog ID
STK415752
SMILES CCCCCCCCCCCCOC(=O)CSc1nc(cc(c1C#N)c1ccccc1)c1ccccc1

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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 C32H38N2O2S MW 514.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H38N2O2S/c1-2-3-4-5-6-7-8-9-10-17-22-36-31(35)25-37-32-29(24-33)28(26-18-13-11-14-19-26)23-30(34-32)27-20-15-12-16-21-27/h11-16,18-21,23H,2-10,17,22,25H2,1H3
InChIKey
MZMWVLFZVTZKAW-UHFFFAOYSA-N
Synonyms

CCCCCCCCCCCCOC(=O)CSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N
dodecyl((3cyano46diphenylpyridin2yl)sulfanyl)acetate
DODECYL2(3CYANO46DIPHENYL2PYRIDYLTHIO)ACETATE
DODECYL2(3CYANO46DIPHENYLPYRIDIN2YL)SULFANYLACETATE
InChI=1SC32H38N2O2Sc1234567891017223631(35)25373229(2433)28(26181311141926)2330(3432)27201512162127h1116182123H210172225H21H3
MFCD02693242
ZINC000101297762
ZINC101297762

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Available files

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