Vitas-M small molecule compound

N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide

Catalog ID
STL151290
SMILES CCc1n[nH]/c(=N/C(=O)CCC(=O)NC2CCCCCCC2)/s1

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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 C16H26N4O2S MW 338.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H26N4O2S/c1-2-15-19-20-16(23-15)18-14(22)11-10-13(21)17-12-8-6-4-3-5-7-9-12/h12H,2-11H2,1H3,(H,17,21)(H,18,20,22)
InChIKey
LXWWSHMCYXFWMA-UHFFFAOYSA-N
Synonyms

713091895
CCC1=NN=C(S1)NC(=O)CCC(=O)NC2CCCCCCC2
CCc1n(nH)c(=NC(=O)CCC(=O)NC2CCCCCCC2)s1
InChI=1SC16H26N4O2Sc1215192016(2315)1814(22)111013(21)1712864357912h12H211H21H3(H1721)(H182022)
MFCD05725366
NcyclooctylN((2Z)5ethyl134thiadiazol2(3H)ylidene)butanediamide
NCYCLOOCTYLN(5ETHYL134THIADIAZOL2YL)BUTANEDIAMIDE
ZINC000001872730
ZINC01872730
ZINC1872730

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Available files

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